Using device 1 (rank 1, local rank 1, local size 2) : Tesla V100-PCIE-16GB Using device 0 (rank 0, local rank 0, local size 2) : Tesla V100-PCIE-16GB running on 2 total cores distrk: each k-point on 2 cores, 1 groups distr: one band on 1 cores, 2 groups ******************************************************************************* You are running the GPU port of VASP! When publishing results obtained with this version, please cite: - M. Hacene et al., http://dx.doi.org/10.1002/jcc.23096 - M. Hutchinson and M. Widom, http://dx.doi.org/10.1016/j.cpc.2012.02.017 in addition to the usual required citations (see manual). GPU developers: A. Anciaux-Sedrakian, C. Angerer, and M. Hutchinson. ******************************************************************************* ----------------------------------------------------------------------------- | | | W W AA RRRRR N N II N N GGGG !!! | | W W A A R R NN N II NN N G G !!! | | W W A A R R N N N II N N N G !!! | | W WW W AAAAAA RRRRR N N N II N N N G GGG ! | | WW WW A A R R N NN II N NN G G | | W W A A R R N N II N N GGGG !!! | | | | Please note that VASP has recently been ported to GPU by means of | | OpenACC. You are running the CUDA-C GPU-port of VASP, which is | | deprecated and no longer actively developed, maintained, or | | supported. In the near future, the CUDA-C GPU-port of VASP will be | | dropped completely. We encourage you to switch to the OpenACC | | GPU-port of VASP as soon as possible. | | | ----------------------------------------------------------------------------- vasp.6.2.1 16May21 (build Apr 11 2022 11:03:26) complex MD_VERSION_INFO: Compiled 2022-04-11T18:25:55-UTC in devlin.sd.materialsdesign. com:/home/medea2/data/build/vasp6.2.1/16685/x86_64/src/src/build/gpu from svn 1 6685 This VASP executable licensed from Materials Design, Inc. POSCAR found type information on POSCAR SiO C H POSCAR found : 4 types and 20 ions NWRITE = 1 NWRITE = 1 LDA part: xc-table for Pade appr. of Perdew WARNING: The GPU port of VASP has been extensively tested for: ALGO=Normal, Fast, and VeryFast. Other algorithms may produce incorrect results or yield suboptimal performance. Handle with care! POSCAR, INCAR and KPOINTS ok, starting setup creating 32 CUDA streams... creating 32 CUDA streams... creating 32 CUFFT plans with grid size 80 x 80 x 98... creating 32 CUFFT plans with grid size 80 x 80 x 98... FFT: planning ... WAVECAR not read entering main loop N E dE d eps ncg rms rms(c) DAV: 1 0.369067627228E+03 0.36907E+03 -0.92627E+03 84 0.580E+02 DAV: 2 0.718223167557E+02 -0.29725E+03 -0.28368E+03 120 0.127E+02 DAV: 3 -0.923618657288E+02 -0.16418E+03 -0.16315E+03 88 0.100E+02 DAV: 4 -0.114558535435E+03 -0.22197E+02 -0.22125E+02 88 0.484E+01 DAV: 5 -0.115133902670E+03 -0.57537E+00 -0.57490E+00 96 0.876E+00 0.192E+01 DAV: 6 -0.105231349857E+03 0.99026E+01 -0.40826E+01 88 0.226E+01 0.115E+01 DAV: 7 -0.103800687441E+03 0.14307E+01 -0.18315E+01 96 0.128E+01 0.751E+00 DAV: 8 -0.102852311412E+03 0.94838E+00 -0.63902E+00 104 0.866E+00 0.391E+00 DAV: 9 -0.102515702041E+03 0.33661E+00 -0.92917E-01 96 0.418E+00 0.870E-01 DAV: 10 -0.102474203397E+03 0.41499E-01 -0.92218E-02 96 0.134E+00 0.535E-01 DAV: 11 -0.102455315468E+03 0.18888E-01 -0.72000E-02 80 0.944E-01 0.557E-01 DAV: 12 -0.102441912381E+03 0.13403E-01 -0.38805E-02 80 0.666E-01 0.232E-01 DAV: 13 -0.102442342444E+03 -0.43006E-03 -0.27832E-02 88 0.452E-01 0.358E-01 DAV: 14 -0.102442652050E+03 -0.30961E-03 -0.11255E-02 88 0.251E-01 0.936E-02 DAV: 15 -0.102445075261E+03 -0.24232E-02 -0.51306E-03 78 0.250E-01 0.694E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.108484447176220E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.108484447176220E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.511622697532899E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.511622697532899E-004 DAV: 16 -0.102452272510E+03 -0.71972E-02 -0.60849E-03 86 0.144E-01 0.438E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -9.520505896173843E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.304243821256789E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -9.520505896173843E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.304243821256789E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.515362396906420E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.515362396906420E-004 DAV: 17 -0.102459804889E+03 -0.75324E-02 -0.81311E-03 88 0.886E-02 0.472E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.513176033894407E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.513176033894407E-004 DAV: 18 -0.102461709228E+03 -0.19043E-02 0.15670E-03 112 0.399E-01 0.255E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514868059807145E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514868059807145E-004 DAV: 19 -0.102465337740E+03 -0.36285E-02 0.97815E-03 104 0.122E-01 0.353E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.516024809153373E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.516024809153373E-004 DAV: 20 -0.102466785163E+03 -0.14474E-02 0.12601E-02 104 0.204E-01 0.242E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.515909054096153E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.515909054096153E-004 DAV: 21 -0.102468558947E+03 -0.17738E-02 0.10630E-02 112 0.102E-01 0.269E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514049726521164E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514049726521164E-004 DAV: 22 -0.102469287693E+03 -0.72875E-03 0.13186E-02 112 0.263E-01 0.221E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.513444861450047E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.513444861450047E-004 DAV: 23 -0.102470822231E+03 -0.15345E-02 0.11190E-02 96 0.190E-01 0.445E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514362943765859E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514362943765859E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.271063706788086E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.271063706788086E-004 DAV: 24 -0.102472167053E+03 -0.13448E-02 0.11568E-02 112 0.390E-01 0.291E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514271251885643E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.514271251885643E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.216997528082776E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.216997528082776E-004 DAV: 25 -0.102474000903E+03 -0.18339E-02 0.13666E-02 96 0.381E-01 0.887E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.513964970964828E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.513964970964828E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.709327332768955E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.052819947135203E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.754851032572648E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.865230096119709E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.709327332768955E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.052819947135203E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.754851032572648E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.865230096119709E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 6.905482751424677E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 7.001029075466552E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 6.905482751424677E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 7.001029075466552E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.468197979325110E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 8.175115631720585E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.268633425552684E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.001081247769662E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.468197979325110E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 8.175115631720585E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.268633425552684E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.001081247769662E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.388302379046591E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.388302379046591E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.748842263094230E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.748842263094230E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.375841649816740E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.375841649816740E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 6.381732325938993E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.421235889250585E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 6.381732325938993E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.421235889250585E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.665330546421685E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.665330546421685E-004 DAV: 26 -0.264248195892E+03 -0.16177E+03 -0.16160E+03 116 0.481E-01 0.429E+01 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.583562602328157E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.725788159884544E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.995897126784370E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.658886641902680E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.432377803935449E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 2.277357384217158E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.455087054747591E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.348177918533604E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.583562602328157E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.725788159884544E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.995897126784370E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.658886641902680E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.432377803935449E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 2.277357384217158E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.455087054747591E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.348177918533604E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 1.068606824440384E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.053736766129880E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.502324296207182E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.885148348565341E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.393980444829852E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.893448130959951E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.137685256041192E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 1.068606824440384E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.053736766129880E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.502324296207182E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.885148348565341E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.393980444829852E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.893448130959951E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.137685256041192E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 7.224953294453080E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.124999307692234E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 7.224953294453080E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.124999307692234E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 7.026876121252609E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.051317479197590E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.796125601181828E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.512508333174566E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.259578919326253E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 8.152011351537743E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.415820876449994E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.060646973558193E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 7.026876121252609E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.051317479197590E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.796125601181828E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.512508333174566E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.259578919326253E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 8.152011351537743E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.415820876449994E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.060646973558193E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 1.144822121817643E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.022304926787791E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 9.047738955891223E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 7.799195432064097E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 4.322710460822220E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 3.196806885321162E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 4.158200378505548E-004 1.144822121817643E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.022304926787791E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 9.047738955891223E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 7.799195432064097E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 4.322710460822220E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 3.196806885321162E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 4.158200378505548E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 3.685295132625195E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.492309061010714E-004 3.685295132625195E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.492309061010714E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.134638132401000E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.939640240113010E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 6.519291057028013E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.134638132401000E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.939640240113010E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 6.519291057028013E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.119211751432218E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.072931361244905E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.119211751432218E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.072931361244905E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -4.899281882333848E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.967021579025169E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 5.039950840930723E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -4.899281882333848E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.967021579025169E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 5.039950840930723E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.616542103629475E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.616542103629475E-005 DAV: 27 -0.101147779874E+03 0.16310E+03 -0.84962E+02 76 0.698E+01BRMIX: very serious problems the old and the new charge density differ old charge density: 44.99970 new 44.99744 0.212E+00 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.055094130442867E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.055094130442867E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.657409265949297E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -9.780691717262602E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.141177729807591E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.062264799368069E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.657409265949297E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -9.780691717262602E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.141177729807591E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.062264799368069E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.304407766706698E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.274655187604774E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.304407766706698E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.274655187604774E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -8.951209708573020E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -6.878656065390890E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -4.397445945321228E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -6.299117874344113E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -7.661100098991869E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.491971241064601E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -2.892126040474269E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.904262963364821E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -8.951209708573020E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -6.878656065390890E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -4.397445945321228E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -6.299117874344113E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -7.661100098991869E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.491971241064601E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -2.892126040474269E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.904262963364821E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 7.266493700796379E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 9.519196013704036E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.134084662573036E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 5.135104496995890E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.333877478952272E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.725476937764099E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.510855085579727E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 7.266493700796379E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 9.519196013704036E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.134084662573036E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 5.135104496995890E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.333877478952272E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.725476937764099E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.510855085579727E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.422816818448823E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.058419325700281E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.422816818448823E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.058419325700281E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 7.035727931520358E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -3.802097075903461E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.139178769071990E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.044891918976964E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -2.896356193584162E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 3.037886547514985E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -4.890171674221819E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.097000127819687E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 7.035727931520358E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -3.802097075903461E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.139178769071990E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.044891918976964E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -2.896356193584162E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 3.037886547514985E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -4.890171674221819E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.097000127819687E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.035930588388685E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 1.247930004446067E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -2.002131919904011E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 5.519550724207488E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.102906175066493E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.661706879428728E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.873716333428970E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 6.542201839078267E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.035930588388685E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 1.247930004446067E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -2.002131919904011E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 5.519550724207488E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.102906175066493E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.661706879428728E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.873716333428970E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 6.542201839078267E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 2.284585084579350E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -6.144852250597347E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 1.785840387725855E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.236194197706439E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 2.284585084579350E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -6.144852250597347E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 1.785840387725855E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.236194197706439E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.378912602528990E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 9.538725331345166E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.464849865892637E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.378912602528990E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 9.538725331345166E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.464849865892637E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 1.415224525021079E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.834109771141115E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.404279653374418E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 1.415224525021079E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.834109771141115E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.404279653374418E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.901229342638446E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.058315843961425E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.305022762957839E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -4.931361355069598E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -3.413582660122848E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.245071776414395E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 3.779103240102587E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 7.968557261124650E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.901229342638446E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.058315843961425E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.305022762957839E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -4.931361355069598E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -3.413582660122848E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.245071776414395E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 3.779103240102587E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 7.968557261124650E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.248455320270334E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -9.124446973207357E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -3.363499635234734E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 4.020737639965653E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.448155559450856E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -6.786325871555578E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.313951942530454E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.248455320270334E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -9.124446973207357E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -3.363499635234734E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 4.020737639965653E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.448155559450856E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -6.786325871555578E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.313951942530454E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 1.378860268051767E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -2.325587390980222E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -6.563679849215728E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 7.209060035242116E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -5.899342814079155E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -4.490160134705171E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 4.141627767848566E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 1.378860268051767E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -2.325587390980222E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -6.563679849215728E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 7.209060035242116E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -5.899342814079155E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -4.490160134705171E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 4.141627767848566E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 7.002653956489110E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.691878570027252E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.044223822341514E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -3.857415523149310E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 6.739261159794115E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -3.598983927989112E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 5.006520940064448E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 7.002653956489110E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.691878570027252E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.044223822341514E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -3.857415523149310E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 6.739261159794115E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -3.598983927989112E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 5.006520940064448E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.493249895514627E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 5.210597019537530E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.493249895514627E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 5.210597019537530E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 8.397701471602912E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.855780774471881E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 8.397701471602912E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.855780774471881E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.063830011961994E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.207249832208656E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.063830011961994E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.207249832208656E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.144886424970216E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.655699688613624E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.144886424970216E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.655699688613624E-003 DAV: 28 -0.123558518671E+04 -0.11344E+04 -0.11218E+04 118 0.681E+00BRMIX: very serious problems the old and the new charge density differ old charge density: 44.99744 new 44.99642 0.192E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -7.281992227510379E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.231768016257394 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.546148063473099 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -2.017271659192737E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.938405459678972E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -4.009878872123238E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.517851432048774E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.203485228828432E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -7.281992227510379E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.231768016257394 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.546148063473099 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -2.017271659192737E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.938405459678972E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -4.009878872123238E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.517851432048774E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.203485228828432E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.323674867419557E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 7.538020248744795E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 7.514254715564539E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 4.602875657726629E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.693282210427320E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.184428434477115E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.070308124009880E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 4.362660623274831E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.323674867419557E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 7.538020248744795E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 7.514254715564539E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 4.602875657726629E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.693282210427320E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.184428434477115E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.070308124009880E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 4.362660623274831E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 2.506582175611711E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -3.411448771543830E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.538375288454018E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.509222656288258E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.564103932046594E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -5.395770359830273E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -9.452811992278548E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -8.635981504506571E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 2.506582175611711E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -3.411448771543830E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.538375288454018E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.509222656288258E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.564103932046594E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -5.395770359830273E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -9.452811992278548E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -8.635981504506571E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -8.374393354797827E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 9.349581721838848E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -3.325609121632966E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.401557216920661E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -2.090896113264033E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 7.924872385706157E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.343931525937327E-003 -8.374393354797827E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 9.349581721838848E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -3.325609121632966E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.401557216920661E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -2.090896113264033E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 7.924872385706157E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.343931525937327E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.217376722606972E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.653959363130968E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.533927660603326E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -4.717767918347777E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -5.023145755789749E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -6.109894533202120E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -5.769688393350144E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -6.133646479381259E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.217376722606972E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.653959363130968E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.533927660603326E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -4.717767918347777E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -5.023145755789749E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -6.109894533202120E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -5.769688393350144E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -6.133646479381259E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 9.858446823471508E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 9.630483488498808E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -4.214474207720777E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -4.594924190005807E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -4.429118836521490E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -4.112184188429586E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -3.966057620942059E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.230148407711058E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 9.858446823471508E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 9.630483488498808E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -4.214474207720777E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -4.594924190005807E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -4.429118836521490E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -4.112184188429586E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -3.966057620942059E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.230148407711058E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 3.438125196781478E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.498798129009494E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 4.889231194698638E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 3.438125196781478E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.498798129009494E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 4.889231194698638E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.083507456045569E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.063694563828101E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.083507456045569E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.063694563828101E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.585371169797789E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.719369906212155E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 7.356055308864584E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 3.452230259312967E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.206690823533374E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.282956345025909E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -8.445681253312239E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.585371169797789E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.719369906212155E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 7.356055308864584E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 3.452230259312967E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.206690823533374E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.282956345025909E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -8.445681253312239E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.125628543807369 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.110424487411349 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -2.733678195404955E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.560851874926271E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 9.217880540706905E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 8.253677716698511E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 8.203754771639499E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 4.725850014341223E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.125628543807369 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.110424487411349 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -2.733678195404955E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.560851874926271E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 9.217880540706905E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 8.253677716698511E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 8.203754771639499E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 4.725850014341223E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.062673533329247E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -1.453837958267636E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.594618151349509E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 3.878168921524813E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.507680794752383E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.374466155286108E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.151963892040880E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 7.331551890209526E-003 -1.062673533329247E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -1.453837958267636E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.594618151349509E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 3.878168921524813E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.507680794752383E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.374466155286108E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.151963892040880E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 7.331551890209526E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -4.534796867543362E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -5.629617245826484E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -4.004085399590101E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 1.650940817423315E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -1.346011762813619E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -1.756078126438246E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -4.267265722688958E-003 -4.534796867543362E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -5.629617245826484E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -4.004085399590101E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 1.650940817423315E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -1.346011762813619E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -1.756078126438246E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -4.267265722688958E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -7.614416606284837E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.640040884585701E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.726440399441827E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -4.106047552024935E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -5.533327292389241E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -6.162600702984179E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -7.697689401778846E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -7.614416606284837E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.640040884585701E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.726440399441827E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -4.106047552024935E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -5.533327292389241E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -6.162600702984179E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -7.697689401778846E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.130151114629928E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -2.165984631043438E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.637253536716087E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.364757395852599E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 4.897450774987718E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.906934026189171E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.407797577132419E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.991859340540987E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.130151114629928E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -2.165984631043438E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.637253536716087E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.364757395852599E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 4.897450774987718E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.906934026189171E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.407797577132419E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.991859340540987E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.089751076182133E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 5.273222190345872E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -9.688120307009768E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.110708861689816 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -7.381227772863358E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.892535780116934E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -6.988347045119490E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -7.556337537845140E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.089751076182133E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 5.273222190345872E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -9.688120307009768E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.110708861689816 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -7.381227772863358E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.892535780116934E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -6.988347045119490E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -7.556337537845140E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 9.003473549098124E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -5.828075655804368E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -2.250741311478150E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.830724373319047E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.413541737351907E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -3.164861473298052E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 2.576003078427263E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -2.876383344527712E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 9.003473549098124E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -5.828075655804368E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -2.250741311478150E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.830724373319047E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.413541737351907E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -3.164861473298052E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 2.576003078427263E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -2.876383344527712E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -7.133771614538297E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 2.779936710296417E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -2.560648798830550E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -2.360127603111850E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -3.027481255501947E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 3.075426378953335E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -3.192298857230409E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 2.421692783593001E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -7.133771614538297E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 2.779936710296417E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -2.560648798830550E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -2.360127603111850E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -3.027481255501947E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 3.075426378953335E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -3.192298857230409E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 2.421692783593001E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -1.034895915397552E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 6.604100011344614E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.293415059331506E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -5.267216874902340E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -1.510348703333570E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 6.550762792121767E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -1.420633986606311E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -1.312537623157894E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -1.034895915397552E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 6.604100011344614E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.293415059331506E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -5.267216874902340E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -1.510348703333570E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 6.550762792121767E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -1.420633986606311E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -1.312537623157894E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 8.120209656911181E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 7.987514445256324E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 8.120209656911181E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 7.987514445256324E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 2.332377210787867E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.812192695533157E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 2.332377210787867E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.812192695533157E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.780416521784309E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -5.797106605019899E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.780416521784309E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -5.797106605019899E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.626526795993535E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.905206278730969E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.626526795993535E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.905206278730969E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.990205834555934E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.227080521800888E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.990205834555934E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.227080521800888E-002 DAV: 29 -0.141729551307E+05 -0.12937E+05 -0.14165E+05 120 0.134E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 44.99642 new 45.23757 0.317E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.113738745110107 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.058156928796348E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.761960843470649E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.677685191583499E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.422357367476824E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -5.151636525605214E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.411705046036046 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -4.354943751329248E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.113738745110107 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.058156928796348E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.761960843470649E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.677685191583499E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.422357367476824E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -5.151636525605214E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.411705046036046 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -4.354943751329248E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.332064353869771 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.201948892816922 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.161451876703378 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.185312267846192 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 4.483016474771784E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.179570487783434 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.342811329136500 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.137564256774804E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.332064353869771 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.201948892816922 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.161451876703378 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.185312267846192 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 4.483016474771784E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.179570487783434 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.342811329136500 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.137564256774804E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.204640339026494 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -7.334760222911547E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -4.550594929496320E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 4.903047095489229E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.719263878475397E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -7.841210819355160E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.218548600267219 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 6.122199091145540E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.204640339026494 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -7.334760222911547E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -4.550594929496320E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 4.903047095489229E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.719263878475397E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -7.841210819355160E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.218548600267219 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 6.122199091145540E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -3.814091606606057E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.204136642523813 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.320643012013258 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.264014697945896 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 8.502812666996494E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -5.188283933663660E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.478775572911486 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -3.814091606606057E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.204136642523813 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.320643012013258 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.264014697945896 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 8.502812666996494E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -5.188283933663660E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.478775572911486 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.163610333530268 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.772298941128251E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.138984608765412 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.106543114972849 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.405003190555082E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.266395379208795E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.113736199559706 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.394070229428138 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.163610333530268 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.772298941128251E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.138984608765412 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.106543114972849 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.405003190555082E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.266395379208795E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.113736199559706 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.394070229428138 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -4.717950586808868E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.940662732457260E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -4.064728120586407E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.861920954425580E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.134199920337628 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.174680229695170 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 9.526570652329472E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.122236360940795 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -4.717950586808868E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.940662732457260E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -4.064728120586407E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.861920954425580E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.134199920337628 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.174680229695170 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 9.526570652329472E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.122236360940795 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -5.345532765621165E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 1.883602273968966E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.636975119488899E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.565985161545275E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.625864461470606E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 2.710274047394127E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 4.292076566448012E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.187572147722017 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -5.345532765621165E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 1.883602273968966E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.636975119488899E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.565985161545275E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.625864461470606E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 2.710274047394127E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 4.292076566448012E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.187572147722017 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.902414543738601E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 9.958443005501543E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -9.348255399010689E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -2.711762843157277E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 2.573003844682555E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.328807365501154E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.315359252194589E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 3.135344409845794E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.902414543738601E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 9.958443005501543E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -9.348255399010689E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -2.711762843157277E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 2.573003844682555E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.328807365501154E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.315359252194589E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 3.135344409845794E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.250210678717180 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.246697958379151 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 4.523733580084206E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.255340390036481E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 3.222777043402340E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.644805672058229E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 4.381840018929829E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 9.181921081896817E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.250210678717180 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.246697958379151 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 4.523733580084206E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.255340390036481E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 3.222777043402340E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.644805672058229E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 4.381840018929829E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 9.181921081896817E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -5.124468682933779E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -7.066609167952934E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.263671850969280 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.220542075038423 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 7.842354504141255E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.041943528144999E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.434548853220006E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -9.123987998092701E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -5.124468682933779E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -7.066609167952934E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.263671850969280 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.220542075038423 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 7.842354504141255E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.041943528144999E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.434548853220006E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -9.123987998092701E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.107487681977059 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.107487681977059 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -2.060176402532031E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 6.646705537488770E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 4.803156058828642E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.550875132391303E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 6.201898085015370E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 7.286446290180559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.244965262549574E-002 -2.060176402532031E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 6.646705537488770E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 4.803156058828642E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.550875132391303E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 6.201898085015370E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 7.286446290180559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.244965262549574E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -3.107858916008678E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 5.955420568424925E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -7.534990180975807E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.651041468163914E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 3.242963169379216E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 5.270984785909105E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 2.330471436868700E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -3.333533022088326E-002 -3.107858916008678E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 5.955420568424925E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -7.534990180975807E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.651041468163914E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 3.242963169379216E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 5.270984785909105E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 2.330471436868700E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -3.333533022088326E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -8.358184304052458E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -7.900178808573665E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -4.953790513436712E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.090678647819691E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.127150915758612E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -8.358184304052458E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -7.900178808573665E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -4.953790513436712E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.090678647819691E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.127150915758612E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 1.710680789696332E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 4.464613098444274E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.119609972098599 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -9.932965000454058E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 4.175692183022754E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 5.445448253271029E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.283349719264244 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.661910502857411 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 1.710680789696332E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 4.464613098444274E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.119609972098599 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -9.932965000454058E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 4.175692183022754E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 5.445448253271029E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.283349719264244 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.661910502857411 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -4.443734969646721E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.067610138883630E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.320232260953160E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.086635849194645E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -9.338454345089417E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.183777703531555E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.118319449543335 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 6.877626161010827E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -4.443734969646721E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.067610138883630E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.320232260953160E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.086635849194645E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -9.338454345089417E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.183777703531555E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.118319449543335 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 6.877626161010827E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.516311420935693E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -7.911629455073352E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -7.166005348475694E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -5.741169115609443E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -5.067241618302082E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 4.652652300280444E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -5.805650187096559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.890422402459402E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.516311420935693E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -7.911629455073352E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -7.166005348475694E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -5.741169115609443E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -5.067241618302082E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 4.652652300280444E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -5.805650187096559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.890422402459402E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 5.206580508833892E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -3.922377757426963E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -6.477999512415114E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.250930987508840E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.406745413865371E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -3.491312708885302E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 9.453776548265187E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.125853893600337 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 5.206580508833892E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -3.922377757426963E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -6.477999512415114E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.250930987508840E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.406745413865371E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -3.491312708885302E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 9.453776548265187E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.125853893600337 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 6.127290320912453E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.371246047516405E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.683059535476396E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -1.643094391882098E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.428577544121721E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -2.853335771888942E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.106777030635533 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.118675270044448 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 6.127290320912453E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.371246047516405E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.683059535476396E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -1.643094391882098E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.428577544121721E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -2.853335771888942E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.106777030635533 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.118675270044448 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -4.743873070726263E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -9.819379738990644E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -4.743873070726263E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -9.819379738990644E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.279326666961536 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.676806589557476 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.279326666961536 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.676806589557476 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.450850935766857 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.755220848280878 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.450850935766857 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.755220848280878 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.147075698769851 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.201193254233895 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.147075698769851 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.201193254233895 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -7.938334503105282E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 7.969029408639559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -7.938334503105282E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 7.969029408639559E-002 DAV: 30 -0.235451220632E+04 0.11818E+05 -0.22221E+04 120 0.325E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 45.23757 new 45.27353 0.593E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.417580787842167 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.208189769543851 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.154060599328129 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.119608224150129 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.474303042538909 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.422149040581269 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.479583234901402 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.241640280917655 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.417580787842167 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.208189769543851 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.154060599328129 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.119608224150129 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.474303042538909 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.422149040581269 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.479583234901402 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.241640280917655 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.118555593500875 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.139346585452926 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.543018240847050 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.391476044289909 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.953747202132013 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 9.953992536044595E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.826304963635778 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.108668496239718 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.118555593500875 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.139346585452926 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.543018240847050 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.391476044289909 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.953747202132013 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 9.953992536044595E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.826304963635778 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.108668496239718 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.172355777925301E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.697968745002970 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.134660071395677 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.263679894858970 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.240165272990147 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 5.605527873211456E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.172355777925301E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.697968745002970 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.134660071395677 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.263679894858970 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.240165272990147 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 5.605527873211456E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.286073921436975 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -5.535961703681919E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.286073921436975 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -5.535961703681919E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.795447412039138E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.108526244887683 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.772405243047665 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.226857856906629 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.920993281275053E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.101344721715189 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.310810325040808E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.135972711200335 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.795447412039138E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.108526244887683 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.772405243047665 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.226857856906629 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.920993281275053E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.101344721715189 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.310810325040808E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.135972711200335 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.240544677929618 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.155391794499485 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -4.282756797261603E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.115162604576924 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.245960996343444 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.078952492428687E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.137828553738689 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.127460717463845 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.240544677929618 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.155391794499485 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -4.282756797261603E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.115162604576924 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.245960996343444 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.078952492428687E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.137828553738689 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.127460717463845 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 4.495798377055709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -2.312272014472860E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.602188615639451E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.107951245142834 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.163149502144411 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 7.494337157603037E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 7.621658553390762E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.134178844034413 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 4.495798377055709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -2.312272014472860E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.602188615639451E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.107951245142834 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.163149502144411 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 7.494337157603037E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 7.621658553390762E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.134178844034413 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 3.565253241563211E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 2.997113605103315E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 7.354507551197756E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.210673238312864E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.183187620047311 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 7.963030893902492E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 8.188681204485275E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 3.086389059570237E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 3.565253241563211E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 2.997113605103315E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 7.354507551197756E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.210673238312864E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.183187620047311 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 7.963030893902492E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 8.188681204485275E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 3.086389059570237E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -5.771454687438280E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 3.851927314076144E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 7.798120304228680E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.951230501077000E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 9.339277205156575E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.053053507345635E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.697521175759257E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 4.825584301975904E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -5.771454687438280E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 3.851927314076144E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 7.798120304228680E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.951230501077000E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 9.339277205156575E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.053053507345635E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.697521175759257E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 4.825584301975904E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.514773360239848 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.304631283516546 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 6.146491988542088E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.105178753919038 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.109576128746807 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -4.486004024677590E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -8.883105984267721E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 9.659874184798994E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.514773360239848 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.304631283516546 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 6.146491988542088E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.105178753919038 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.109576128746807 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -4.486004024677590E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -8.883105984267721E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 9.659874184798994E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -6.303233590923199E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.120006043917408 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 8.859835146299889E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.588748683540319E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.112681413727501 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -6.204053792953010E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.359718396622817E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.252481076461354E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -6.303233590923199E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.120006043917408 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 8.859835146299889E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.588748683540319E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.112681413727501 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -6.204053792953010E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.359718396622817E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.252481076461354E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.259124439514246E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -7.694787399311601E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.151851633242986 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.144349346510615 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 5.511813658865296E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.131241668007416E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -7.959269915876588E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 3.470330416956418E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.259124439514246E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -7.694787399311601E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.151851633242986 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.144349346510615 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 5.511813658865296E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.131241668007416E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -7.959269915876588E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 3.470330416956418E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -9.552388320701908E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.576448262102777E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 8.324329085672130E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -3.223493992994765E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.592401589473828E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.841517820890261E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.169710524505097E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -9.245969977438016E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -9.552388320701908E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.576448262102777E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 8.324329085672130E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -3.223493992994765E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.592401589473828E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.841517820890261E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.169710524505097E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -9.245969977438016E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.848048214406294E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.002739783998563E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.324224675103410E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.158149897693793 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.848048214406294E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.002739783998563E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.324224675103410E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.158149897693793 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -8.164604050012426E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.134639127044413 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.156320856315267E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.145123375891890 -8.164604050012426E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.134639127044413 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.156320856315267E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.145123375891890 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.675222957179389E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -1.065626773947853E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -3.410726895197388E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.164385382918307 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -2.127057337913723E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.167101198046935 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -2.574754454009796E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.118598469229789 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.675222957179389E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -1.065626773947853E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -3.410726895197388E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.164385382918307 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -2.127057337913723E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.167101198046935 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -2.574754454009796E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.118598469229789 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 9.565770829553150E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -9.902445626989300E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -2.635412394519023E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.118358264765659 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 4.302733484810120E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 6.138992558951159E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -6.100326139112532E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.117379669948905 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 9.565770829553150E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -9.902445626989300E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -2.635412394519023E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.118358264765659 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 4.302733484810120E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 6.138992558951159E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -6.100326139112532E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.117379669948905 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 3.769836703893997E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -3.927477651833046E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.402582346454002E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -7.857627322544362E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 5.669718585549906E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.339982379490204E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -5.202626950087284E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -2.856642699065053E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 3.769836703893997E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -3.927477651833046E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.402582346454002E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -7.857627322544362E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 5.669718585549906E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.339982379490204E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -5.202626950087284E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -2.856642699065053E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 5.363375300401677E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.137788336416195 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 5.363375300401677E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.137788336416195 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 9.897688232429337E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.222818576420012 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 9.897688232429337E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.222818576420012 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.336190071621282E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.872357507305101E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.336190071621282E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.872357507305101E-002 DAV: 31 -0.359966725719E+04 -0.12452E+04 -0.34553E+04 100 0.259E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 45.27353 new 46.50583 0.774E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.449186104173896E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.325317386904098 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.177232599607666 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.39343105950230 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.63346306606315 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.732835591030592 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.109394911120835 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.027749083131858E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.449186104173896E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.325317386904098 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.177232599607666 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.39343105950230 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.63346306606315 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.732835591030592 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.109394911120835 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -3.027749083131858E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.170651840124950 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.203130603681739 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.274958393228140 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.787404240128065 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.249387770505827 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.127696379235600 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.122647315394394 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.100124963538070 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.170651840124950 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.203130603681739 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.274958393228140 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.787404240128065 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.249387770505827 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.127696379235600 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.122647315394394 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.100124963538070 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.172060119805440 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.302468061321152 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.200604680128897 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.112929459626365 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.339509681434339 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.139331642931298 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.349320658245304 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 8.092371532930870E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.172060119805440 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.302468061321152 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.200604680128897 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.112929459626365 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.339509681434339 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.139331642931298 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.349320658245304 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 8.092371532930870E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.167852439674622 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.200583893349211 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 0.150220684493823 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.134198273906635 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.152383897180486 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.206741508453155 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 6.851092664813100E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -1.705191402420526E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.167852439674622 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.200583893349211 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 0.150220684493823 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.134198273906635 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.152383897180486 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.206741508453155 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 6.851092664813100E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -1.705191402420526E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.155786313320814 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.389745701625797 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 0.143466501504531 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.127069111483830 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 8.045978003401218E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.198884350908886 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 2.312666856593248E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -4.517610468746361E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.155786313320814 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.389745701625797 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 0.143466501504531 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.127069111483830 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 8.045978003401218E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.198884350908886 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 2.312666856593248E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -4.517610468746361E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.431185052986453 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.159815092726597E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -8.400105668376301E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.237834625446893 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.171269592212159 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.133247228471903 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.813591460371392E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -7.666368904455452E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.431185052986453 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.159815092726597E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -8.400105668376301E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.237834625446893 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.171269592212159 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.133247228471903 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.813591460371392E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -7.666368904455452E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.284624515718722 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -3.649709191488434E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.240106435007379 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.146611971564537 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.334304812743086 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.202954120005655 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.385843126681574 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 8.194348264699805E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.284624515718722 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -3.649709191488434E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.240106435007379 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.146611971564537 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.334304812743086 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.202954120005655 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.385843126681574 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 8.194348264699805E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.222289310249335 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.578670053091054E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.256854861262137 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 3.115618374283383E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.331122453381029 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 5.133211185145278E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.170885767733915 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.699441200182080E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.222289310249335 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.578670053091054E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.256854861262137 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 3.115618374283383E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.331122453381029 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 5.133211185145278E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.170885767733915 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.699441200182080E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -0.161385909294016 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -3.414401382049797E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -3.569833674698569E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.962121684329991E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -3.100981611319789E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 8.947458666898318E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.565816821259846E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 9.937896946728146E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -0.161385909294016 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -3.414401382049797E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -3.569833674698569E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.962121684329991E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -3.100981611319789E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 8.947458666898318E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.565816821259846E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 9.937896946728146E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -8.505098170994317E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -9.612785454655244E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -4.438956936251345E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.010189333292905E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 6.220938563657106E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.273285201975478E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 2.624453821697579E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 3.841408957976328E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -8.505098170994317E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -9.612785454655244E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -4.438956936251345E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.010189333292905E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 6.220938563657106E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.273285201975478E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 2.624453821697579E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 3.841408957976328E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.620896428939040E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -6.815263375460810E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -5.609124075069474E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 8.078691121820583E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.877300762504195E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.322065243372154 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.455675211840124E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.338059198248967E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.620896428939040E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -6.815263375460810E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -5.609124075069474E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 8.078691121820583E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.877300762504195E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.322065243372154 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.455675211840124E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.338059198248967E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -7.911070219791953E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.170028832434837 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 7.684862905234795E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.139898551024440 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -4.945989784748313E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.806952379560789E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.340650981012833 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.126743849724275 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -7.911070219791953E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.170028832434837 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 7.684862905234795E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.139898551024440 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -4.945989784748313E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.806952379560789E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.340650981012833 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.126743849724275 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 4.130755398064331E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.480833537781537E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 3.834335490942079E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 7.187840854610250E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.687308423773904E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.103476806933193E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.400059973954080 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.363286611894972 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 4.130755398064331E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.480833537781537E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 3.834335490942079E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 7.187840854610250E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.687308423773904E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.103476806933193E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.400059973954080 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.363286611894972 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -7.930128581815163E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.270951596518025 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.570602109750330 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.558973886959175E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.922685497776200E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.404399217044779 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.170438587582724 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 5.874110033979794E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -7.930128581815163E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.270951596518025 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.570602109750330 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.558973886959175E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.922685497776200E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.404399217044779 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.170438587582724 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 5.874110033979794E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.554577330818754E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.510630984104104 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.396188873336787 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.542213114998618 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.200134723019425 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.570093886816027 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -9.467566928647435E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -5.908322641975942E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.554577330818754E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.510630984104104 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.396188873336787 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.542213114998618 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.200134723019425 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.570093886816027 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -9.467566928647435E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -5.908322641975942E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 3.301162518168835E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.383093494560459 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.246632167566963 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.487708162187245 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.205837259101592 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.345829049826849 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 4.884379748734739E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -7.074575194781108E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 3.301162518168835E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.383093494560459 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.246632167566963 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.487708162187245 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.205837259101592 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.345829049826849 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 4.884379748734739E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -7.074575194781108E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.129774837772360 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.179332444419286 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -3.558192547936274E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -2.980694594401477E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -0.252357517866418 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.311235147087486 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.180780074481130 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.105089426432234 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.129774837772360 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.179332444419286 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -3.558192547936274E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -2.980694594401477E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -0.252357517866418 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.311235147087486 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.180780074481130 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.105089426432234 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.105276921124855 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -8.362668817105762E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 6.414248850526373E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 7.208453999318218E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -0.272660683952003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.166455488736916 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.287633450790942 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -0.155845125342622 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.105276921124855 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -8.362668817105762E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 6.414248850526373E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 7.208453999318218E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -0.272660683952003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.166455488736916 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.287633450790942 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -0.155845125342622 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.830816257826464E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.259578801798290 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.830816257826464E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.259578801798290 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.138026166409212 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.301579760689276 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.138026166409212 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.301579760689276 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.297565005710428 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.463678707092055 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.297565005710428 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.463678707092055 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.614845348243699 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.753145205602547 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.614845348243699 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.753145205602547 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.651987316073513 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.992895503707078 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.651987316073513 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.992895503707078 DAV: 32 -0.110832678219E+05 -0.74836E+04 -0.78734E+04 120 0.208E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 46.50583 new 46.26991 0.892E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.167830508026143 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.241146352239303 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.125134007324663E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.972078866251098E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -7.332343051848847E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.686054334009545 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -2.370967602022499E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.265091858619912 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.167830508026143 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.241146352239303 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.125134007324663E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.972078866251098E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -7.332343051848847E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.686054334009545 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -2.370967602022499E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.265091858619912 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.737208634458477 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.203284643311066 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.137876451418728 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.431208125721996 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.234056620895194 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.681164270252663 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.179965942853560 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.356634902527283 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.737208634458477 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.203284643311066 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.137876451418728 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.431208125721996 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.234056620895194 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.681164270252663 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.179965942853560 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.356634902527283 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -3.756603285493469E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.693829551874936 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.298739832684716 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.711484314996831 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.104738884218402 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.180062381601243 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.168256017896714 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.300112983188758 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -3.756603285493469E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.693829551874936 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.298739832684716 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.711484314996831 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.104738884218402 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.180062381601243 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.168256017896714 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.300112983188758 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -4.656598413869525E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.19421603919999 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.541517228169951E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.224195075216391 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.26489179983893 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.317691075190317 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.202269125722446 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.206981536745816 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -4.656598413869525E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.19421603919999 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.541517228169951E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.224195075216391 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.26489179983893 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.317691075190317 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.202269125722446 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.206981536745816 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.04355165569669 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.548145616187182 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.354730356712659 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.676929567786775 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.393350296869159 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.325203643696633 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.531807394033982 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.244309972268194 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.04355165569669 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.548145616187182 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.354730356712659 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.676929567786775 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.393350296869159 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.325203643696633 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.531807394033982 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.244309972268194 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.238142076736231 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.389469623827061 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.131401495209014 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.355709425534595 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.057932839324045E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -2.664453346071686E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.55908737388349 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.386131952259805 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.238142076736231 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.389469623827061 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.131401495209014 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.355709425534595 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.057932839324045E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -2.664453346071686E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.55908737388349 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.386131952259805 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.589693392168340 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.813882786490664 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 4.521369109001073E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.201835043446579 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.619040958365929 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -7.693815588956100E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.665069980215238 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -2.370669793831269E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.589693392168340 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.813882786490664 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 4.521369109001073E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.201835043446579 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.619040958365929 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -7.693815588956100E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.665069980215238 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -2.370669793831269E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 1.43893814358595 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.794767321328576 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 5.521767291792382E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.100196025732919 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.542426836452005 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -5.387460211265194E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -0.202140793470502 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -4.557021203790440E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 1.43893814358595 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.794767321328576 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 5.521767291792382E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.100196025732919 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.542426836452005 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -5.387460211265194E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -0.202140793470502 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -4.557021203790440E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.440096672875225 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 5.975149156363266E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -3.773983162302880E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.791541441081055E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.147934999994635 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.416492782330747E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.115199732919999 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.111428628034611 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.440096672875225 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 5.975149156363266E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -3.773983162302880E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.791541441081055E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.147934999994635 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.416492782330747E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.115199732919999 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.111428628034611 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.638425031095742 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.111880268909109 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -9.567586279888612E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.069564331375378E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.299203998214539 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.834491381820293E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.117416789357187 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.679053453097744E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.638425031095742 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.111880268909109 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -9.567586279888612E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -7.069564331375378E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.299203998214539 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.834491381820293E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.117416789357187 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.679053453097744E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.782648321621038 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 4.189817251332576E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.370744855774353E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.115773519176805 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.211632591013617 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -8.853867072992989E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.299302054638993 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -7.990454442178369E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.782648321621038 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 4.189817251332576E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.370744855774353E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.115773519176805 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.211632591013617 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -8.853867072992989E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.299302054638993 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -7.990454442178369E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.303706030918820 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.109071633328375E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.102740153518289E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -9.700202848627139E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.208317135522166 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -6.268450179560293E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.197323982285315 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -5.201115982473277E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.303706030918820 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.109071633328375E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.102740153518289E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -9.700202848627139E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.208317135522166 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -6.268450179560293E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.197323982285315 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -5.201115982473277E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.124163995374289 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.665315821619357E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.548774419256802E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -3.520958698448034E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.116336856467737 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -4.494629203085931E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -8.249186891915390E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -2.112808135839150E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.124163995374289 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.665315821619357E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.548774419256802E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -3.520958698448034E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.116336856467737 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -4.494629203085931E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -8.249186891915390E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -2.112808135839150E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.030894949320314E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -7.470256276830105E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.430178015521132E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.252841213252404 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.715045922045134E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -3.538226721485085E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 3.445850974151630E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.984553349648931E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.030894949320314E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -7.470256276830105E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.430178015521132E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.252841213252404 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.715045922045134E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -3.538226721485085E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 3.445850974151630E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.984553349648931E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -6.074220599133960E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.210557763537330 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.518682706565096 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.205019940167544 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.156893848990592 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.203069992892663 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 9.917198714901197E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.161270758825787 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -6.074220599133960E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.210557763537330 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.518682706565096 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.205019940167544 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -0.156893848990592 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.203069992892663 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 9.917198714901197E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.161270758825787 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.590243883342382E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.125257228138747 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.144467859639212 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.775569430463248 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 3.566202743931061E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -4.953982590980647E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.512599122190718E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.235723489947943 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.590243883342382E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.125257228138747 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.144467859639212 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.775569430463248 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 3.566202743931061E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -4.953982590980647E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.512599122190718E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.235723489947943 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -3.997452916084360E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.234148314117437 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.138350399850294 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.756874077123666 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -1.657220393928478E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -8.077080057101090E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -3.811153896852405E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.327066602450479 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -3.997452916084360E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.234148314117437 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.138350399850294 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.756874077123666 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -1.657220393928478E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -8.077080057101090E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -3.811153896852405E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.327066602450479 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -5.083054223831904E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.159905853168288 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -4.940774920593359E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.548184948262919 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -2.840710896083531E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -7.765354253901226E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -1.075208200966359E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -0.229127828856112 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -5.083054223831904E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.159905853168288 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -4.940774920593359E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.548184948262919 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -2.840710896083531E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -7.765354253901226E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -1.075208200966359E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -0.229127828856112 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -6.784379612999909E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.303916881824617 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -6.784379612999909E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.303916881824617 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.451088891590812 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.506729917592803 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.451088891590812 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.506729917592803 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.226565558242911 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.312558906529729 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.226565558242911 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.312558906529729 DAV: 33 -0.186799794880E+05 -0.75967E+04 -0.15431E+05 116 0.321E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 46.26991 new 45.25628 0.928E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 5.306123456104213E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -6.021235080222811E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.670580447989428 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.134592716785311 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.311039544923716 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.303742734242673 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.730727052188148 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.244190967254556 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 5.306123456104213E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -6.021235080222811E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.670580447989428 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.134592716785311 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.311039544923716 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.303742734242673 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.730727052188148 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.244190967254556 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.211474533084271 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -4.15655652507876 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.49672694646984 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.75115953126434 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.660128649626636 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.195216403221753 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.145974906187385 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.416203352751059 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.211474533084271 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -4.15655652507876 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.49672694646984 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.75115953126434 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.660128649626636 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.195216403221753 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.145974906187385 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.416203352751059 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.315247058853940 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -3.00604666666822 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.34578817933444 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.92331750045979 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.876538845439511 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.216892773153811 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.346839923671666 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.18781793484162 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.315247058853940 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -3.00604666666822 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.34578817933444 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.92331750045979 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.876538845439511 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.216892773153811 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.346839923671666 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.18781793484162 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 1.44927841012463 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -2.13455789082348 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.19844723555400 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 2.65716369198548 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.62785236500535 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.106467028538001 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.552134566934414 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.569981888762831 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 1.44927841012463 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -2.13455789082348 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.19844723555400 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 2.65716369198548 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.62785236500535 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.106467028538001 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.552134566934414 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.569981888762831 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.41022717593019 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.539016564410138 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 0.651340366722232 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.39609837595124 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.78529473103826 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.871839410695447E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.561603585510738 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.771445179785162 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.41022717593019 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.539016564410138 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 0.651340366722232 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.39609837595124 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.78529473103826 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.871839410695447E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.561603585510738 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.771445179785162 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.130677053686797 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -7.259547884357159E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.555506237256608 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.476362003046412 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.235954063343648 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.353744117567141 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.606374777830278 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.12281061188007 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.130677053686797 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -7.259547884357159E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.555506237256608 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.476362003046412 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.235954063343648 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.353744117567141 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.606374777830278 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.12281061188007 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.499654185814515 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.395376761898665 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.03256898900754 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.554214058346564 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.23221275060436 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.643708942136644 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.195504796763079 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.37930375130594 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.499654185814515 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.395376761898665 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.03256898900754 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.554214058346564 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.23221275060436 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.643708942136644 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.195504796763079 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.37930375130594 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.950520513472400 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.834096938366655 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.805551204708885 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.10904339614037 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.15947759746170 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.425744954081000 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.998357238490591 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.587604648956062 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.950520513472400 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.834096938366655 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.805551204708885 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.10904339614037 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.15947759746170 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.425744954081000 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.998357238490591 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.587604648956062 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 2.65607748398201 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 0.764058057987254 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.279634889885365 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.943573669531950 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.399390218922921 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.978674586070461 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.375590139989717 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.146597133045625 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 2.65607748398201 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 0.764058057987254 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.279634889885365 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.943573669531950 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.399390218922921 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.978674586070461 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.375590139989717 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.146597133045625 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 3.14793568371566 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 1.50041401962646 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.18242698608182 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.840769849568206 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -5.688859752564926E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.974313824785149 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -2.010957507559732E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.268403475969910 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 3.14793568371566 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 1.50041401962646 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -1.18242698608182 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.840769849568206 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -5.688859752564926E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.974313824785149 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -2.010957507559732E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.268403475969910 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -5.538227820549462E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.297486044768494 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.371778334982526 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.118781061672042E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.195124688105589 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.443587538735284 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.243992521233539E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.483515908831268E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -5.538227820549462E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.297486044768494 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.371778334982526 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -1.118781061672042E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.195124688105589 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.443587538735284 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.243992521233539E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.483515908831268E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 9.287612300042046E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.221380403961997 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 9.432887497452513E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.203670518749372 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 9.004339315143797E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.21144641670437 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 9.342525671639880E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -7.398944234493217E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 9.287612300042046E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.221380403961997 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 9.432887497452513E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.203670518749372 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 9.004339315143797E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.21144641670437 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 9.342525671639880E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -7.398944234493217E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.196400565019603 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.541624797954556 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.452803937985442E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.163749819800689 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.429079034400552 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.13473123238045 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.393313277091818 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.244392835914146 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.196400565019603 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.541624797954556 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.452803937985442E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.163749819800689 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.429079034400552 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.13473123238045 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 0.393313277091818 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.244392835914146 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -8.584882860857546E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 0.383158366234346 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.411181342608403E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.624474805203402E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.502538016999357 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 1.00899471349638 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.438282792359091 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.240814048072129 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -8.584882860857546E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 0.383158366234346 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.411181342608403E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -3.624474805203402E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.502538016999357 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 1.00899471349638 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.438282792359091 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.240814048072129 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -0.101094935531817 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.182353208504746 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.135521045093619E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -1.272400696181827E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.414185509363271 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.659690363439046 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.401755320530415 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.120724490380420 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -0.101094935531817 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.182353208504746 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.135521045093619E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -1.272400696181827E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.414185509363271 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.659690363439046 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.401755320530415 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.120724490380420 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.177267590938204 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.245838814643176E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.525010349564076E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.841457221941115E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -2.978499264698030E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.212921227857913 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.145843606273052 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.130258833750830 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.177267590938204 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.245838814643176E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.525010349564076E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.841457221941115E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -2.978499264698030E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.212921227857913 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.145843606273052 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.130258833750830 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.460347122987228 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.209297139094164 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.172819538275380 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.389016868185046 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.00783288986494 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.354467308487522 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.667455256806979 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.460347122987228 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.209297139094164 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.172819538275380 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.389016868185046 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.00783288986494 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.354467308487522 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.667455256806979 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.304509364973938 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.460681602633731 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.334288248515828 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 5.139592367318432E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.486595139808879 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.13000279907966 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.02034209674510 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.49712984324766 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.304509364973938 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.460681602633731 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.334288248515828 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 5.139592367318432E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.486595139808879 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.13000279907966 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.02034209674510 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.49712984324766 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.371285883450431 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.243038957857948 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.920752108931539 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.424409664283750 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.57563132855346 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -1.52813699857362 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.17551117185600 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.08163096998463 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.371285883450431 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.243038957857948 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.920752108931539 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.424409664283750 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.57563132855346 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -1.52813699857362 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.17551117185600 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.08163096998463 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.325457979428857 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.197942457505281 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.946868230406075 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.589854984010472 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.937023238372123 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.505719959281774 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.27188390676974 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.26028655338529 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.325457979428857 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -0.197942457505281 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.946868230406075 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.589854984010472 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.937023238372123 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.505719959281774 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.27188390676974 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.26028655338529 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.921100448850538E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.843315721948517E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.921100448850538E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.843315721948517E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.07277476673411 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.99679283930424 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.07277476673411 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.99679283930424 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.05062527178026 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.278045377634412 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.05062527178026 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.278045377634412 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.71432753406828 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.385780119468107 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.71432753406828 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.385780119468107 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.26939653225343 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.723003605184858 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.26939653225343 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.723003605184858 DAV: 34 -0.305561454356E+05 -0.11876E+05 -0.24774E+05 136 0.362E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 45.25628 new 45.26414 0.115E+03 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.20470261911920 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.25611511610294 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.528673987732299 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.365933275938016 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.166502130929212 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.502443845764128 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.558662325791649 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.73781980505097 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.20470261911920 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.25611511610294 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.528673987732299 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.365933275938016 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.166502130929212 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.502443845764128 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.558662325791649 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.73781980505097 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.19423874846158 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.47924975990037 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.88953778483148 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.478074463715001 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.59435221595708 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.17161378031547 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.686028643800259 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.136778073486002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -2.19423874846158 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.47924975990037 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.88953778483148 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.478074463715001 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.59435221595708 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 1.17161378031547 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -0.686028643800259 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.136778073486002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.710414891060401 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 3.73452710460596 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 5.76159157245268 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.29085365550929 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 4.56852129818055 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 2.81676781737767 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.80433073296932 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.999952903154023 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.710414891060401 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 3.73452710460596 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 5.76159157245268 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.29085365550929 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 4.56852129818055 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 2.81676781737767 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.80433073296932 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.999952903154023 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 1.91839925598109 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.25734269598865 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 5.02947924388150 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 4.52439800831612 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 4.70667543027410 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 2.18378623652600 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.820764340011912 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.43832163826949 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 1.91839925598109 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.25734269598865 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 5.02947924388150 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 4.52439800831612 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 4.70667543027410 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 2.18378623652600 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.820764340011912 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.43832163826949 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 3.16277319980506 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.56533702230021 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 2.67876308163582 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 3.93414221534157 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 2.80278955759359 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.72155770925654 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.513042020166773 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.30769124737245 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 3.16277319980506 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.56533702230021 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 2.67876308163582 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 3.93414221534157 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 2.80278955759359 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.72155770925654 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.513042020166773 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.30769124737245 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.294579433330216 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.367152335956968 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.73190058456191 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -6.331156141065801E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.354904054483128 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.35401390051616 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.326428822909597 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.241257422784959 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.294579433330216 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.367152335956968 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.73190058456191 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -6.331156141065801E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.354904054483128 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.35401390051616 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.326428822909597 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.241257422784959 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.18538560506481 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.88392389939280 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 11.5017637345760 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.279178646150892 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.68170743594566 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 2.153677515717628E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 3.11266773766631 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.22129298687481 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.18538560506481 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.88392389939280 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 11.5017637345760 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.279178646150892 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.68170743594566 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 2.153677515717628E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 3.11266773766631 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.22129298687481 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.37739850238337 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 9.86217279269301 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 10.4230800584600 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 12.7574671646206 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 5.53550591862200 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 2.89593676299519 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 4.56513579688527 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 4.37143594309365 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.37739850238337 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 9.86217279269301 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 10.4230800584600 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 12.7574671646206 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 5.53550591862200 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 2.89593676299519 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 4.56513579688527 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 4.37143594309365 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 9.96366599735983 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 11.4281321901489 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 8.99163046968680 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 10.0198700349185 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 11.2949494558174 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 5.14098394005719 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 2.32427733261118 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 7.52109485613034 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 9.96366599735983 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 11.4281321901489 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 8.99163046968680 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 10.0198700349185 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 11.2949494558174 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 5.14098394005719 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 2.32427733261118 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 7.52109485613034 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 10.3180134172660 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 11.8428325386201 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 9.09773838723908 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 9.38047687860149 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 11.5547449065174 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 5.25992220321572 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.531423253452923 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 7.10459801905783 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 10.3180134172660 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 11.8428325386201 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 9.09773838723908 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 9.38047687860149 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 11.5547449065174 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 5.25992220321572 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.531423253452923 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 7.10459801905783 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.048757060377964E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.519722027177216 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.120316194911348 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.143339677796751 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.195065617044519 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.823552848840027 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.11997697863339 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.141649065756096 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 2.048757060377964E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.519722027177216 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.120316194911348 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.143339677796751 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.195065617044519 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.823552848840027 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.11997697863339 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.141649065756096 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.188593332560788 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 6.06220653083999 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 5.65727476406310 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.62352226587201 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.16780896460291 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.78722852654044 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.18477227340379 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.47330944628644 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.188593332560788 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 6.06220653083999 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 5.65727476406310 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.62352226587201 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.16780896460291 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.78722852654044 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.18477227340379 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.47330944628644 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.136689791547605 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 7.60231081036638 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 14.2862930985253 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 13.8001323144107 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.82301906285433 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.30139029814728 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 4.53156265132597 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.47428501569378 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.136689791547605 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 7.60231081036638 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 14.2862930985253 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 13.8001323144107 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.82301906285433 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.30139029814728 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 4.53156265132597 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.47428501569378 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 3.832934175817782E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.328439907212134 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -4.318996188478548E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.141623977280843 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.101103859279822 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.404330506524149 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.439541061357633 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.119049815684333 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 3.832934175817782E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.328439907212134 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -4.318996188478548E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.141623977280843 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.101103859279822 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.404330506524149 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.439541061357633 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.119049815684333 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.18176924331595 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.51912934214163 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.88029877956991 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.441632505462908 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.90875833086206 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.126446198571422 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.50934975290828 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.36394635401115 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.18176924331595 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.51912934214163 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.88029877956991 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.441632505462908 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.90875833086206 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.126446198571422 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.50934975290828 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.36394635401115 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.94756425723108 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 5.27031278920973 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.542972582426967 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.370006704791561 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.347941713820058 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.611479603010800 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 5.120177695004888E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 14.7033841973274 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.94756425723108 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 5.27031278920973 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.542972582426967 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.370006704791561 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.347941713820058 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.611479603010800 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 5.120177695004888E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 14.7033841973274 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 5.24926450033132 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 6.01194731972453 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 5.24926450033132 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 6.01194731972453 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -5.549534094666219E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -1.75209764456399 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 2.75932874109761 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.289670951703253 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.607882761721861 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 11.3381402750977 -5.549534094666219E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -1.75209764456399 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 2.75932874109761 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.289670951703253 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.607882761721861 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 11.3381402750977 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.712747203735784 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -6.997365950515071E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.712747203735784 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -6.997365950515071E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 7.26447624672632 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 7.72583608595834 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 7.26447624672632 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 7.72583608595834 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 16.1533381622771 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 19.4003408117258 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 16.1533381622771 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 19.4003408117258 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 17.3497163320075 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 22.9469399841050 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 17.3497163320075 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 22.9469399841050 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 17.4024087054534 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 23.8733499728999 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 17.4024087054534 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 23.8733499728999 DAV: 35 -0.184880899515E+07 -0.18183E+07 -0.15723E+07 112 0.478E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 45.26414 new 46.45918 0.405E+03 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.509275277719691 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.82183490774690 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 110.750794334808 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.85528025058162 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -2.18376696073064 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.81788212109286 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.60460016299824 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.35506180752416 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.509275277719691 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.82183490774690 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 110.750794334808 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.85528025058162 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -2.18376696073064 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.81788212109286 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.60460016299824 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.35506180752416 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 276.423290613173 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 436.886154289316 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 3502.34979862090 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 679.942930181494 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 253.569369710215 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 187.156652054025 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 119.902969927681 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 221.886602637228 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 276.423290613173 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 436.886154289316 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 3502.34979862090 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 679.942930181494 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 253.569369710215 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 187.156652054025 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 119.902969927681 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 221.886602637228 ----------------------------------------------------------------------------- | | | EEEEEEE RRRRRR RRRRRR OOOOOOO RRRRRR ### ### ### | | E R R R R O O R R ### ### ### | | E R R R R O O R R ### ### ### | | EEEEE RRRRRR RRRRRR O O RRRRRR # # # | | E R R R R O O R R | | E R R R R O O R R ### ### ### | | EEEEEEE R R R R OOOOOOO R R ### ### ### | | | | Error EDDDAV: Call to ZHEGV failed. Returncode = 11 2 16 | | | | ----> I REFUSE TO CONTINUE WITH THIS SICK JOB ... BYE!!! <---- | | | ----------------------------------------------------------------------------- ***************************** Error running VASP parallel with MPI #!/bin/bash cd "/home/user/MD/TaskServer/Tasks/172.16.0.10-32000-task35131" export PATH="/home/user/MD/Linux-x86_64/IntelMPI5/bin:$PATH" export LD_LIBRARY_PATH="$LD_LIBRARY_PATH:/home/user/MD/Linux-x86_64/IntelMPI5/lib:/home/user/MD/TaskServer/Tools/vasp-gpu6.2.1/Linux-x86_64" "/home/user/MD/Linux-x86_64/IntelMPI5/bin/mpirun" -r ssh -np 2 "/home/user/MD/TaskServer/Tools/vasp-gpu6.2.1/Linux-x86_64/vasp_gpu" 1 1 *****************************