Using device 0 (rank 0, local rank 0, local size 2) : Tesla V100-PCIE-16GB Using device 1 (rank 1, local rank 1, 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 0.370020965153E+03 0.37002E+03 -0.92241E+03 84 0.580E+02 DAV: 2 0.831879035025E+02 -0.28683E+03 -0.27494E+03 112 0.126E+02 DAV: 3 -0.898515261775E+02 -0.17304E+03 -0.17185E+03 96 0.104E+02 DAV: 4 -0.113861364370E+03 -0.24010E+02 -0.23942E+02 88 0.516E+01 DAV: 5 -0.114511526895E+03 -0.65016E+00 -0.64975E+00 96 0.966E+00 0.189E+01 DAV: 6 -0.104799842974E+03 0.97117E+01 -0.34173E+01 88 0.209E+01 0.111E+01 DAV: 7 -0.103697503871E+03 0.11023E+01 -0.18715E+01 96 0.126E+01 0.778E+00 DAV: 8 -0.102708326955E+03 0.98918E+00 -0.71217E+00 104 0.934E+00 0.398E+00 DAV: 9 -0.102384318761E+03 0.32401E+00 -0.87879E-01 96 0.436E+00 0.174E+00 DAV: 10 -0.102344993678E+03 0.39325E-01 -0.47085E-01 104 0.214E+00 0.115E+00 DAV: 11 -0.102312611255E+03 0.32382E-01 -0.25250E-01 80 0.115E+00 0.664E-01 DAV: 12 -0.102301980286E+03 0.10631E-01 -0.97936E-02 80 0.783E-01 0.554E-01 DAV: 13 -0.102288602294E+03 0.13378E-01 -0.14944E-02 80 0.513E-01 0.463E-01 DAV: 14 -0.102289974996E+03 -0.13727E-02 -0.82374E-02 80 0.638E-01 0.707E-01 DAV: 15 -0.102292130743E+03 -0.21557E-02 -0.69205E-03 88 0.360E-01 0.604E-01 DAV: 16 -0.102292531993E+03 -0.40125E-03 -0.18725E-02 92 0.363E-01 0.379E-01 DAV: 17 -0.102297052895E+03 -0.45209E-02 -0.63110E-03 88 0.278E-01 0.214E-01 DAV: 18 -0.102303087866E+03 -0.60350E-02 -0.22326E-03 72 0.186E-01 0.182E-01 DAV: 19 -0.102307101673E+03 -0.40138E-02 -0.14582E-03 76 0.117E-01 0.115E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.275845109376050E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.275845109376050E-004 DAV: 20 -0.102309389142E+03 -0.22875E-02 0.26983E-03 72 0.173E-01 0.849E-02 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -6.891484713731751E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.548580793667820E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.835817530516420E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.337091012119456E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 6.883400347143596E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.996734901498593E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -6.891484713731751E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.548580793667820E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.835817530516420E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.337091012119456E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 6.883400347143596E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.996734901498593E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.325243934019685E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.325243934019685E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -9.745559430158739E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -9.745559430158739E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.276457251359867E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.276457251359867E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.357533482016889E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.357533482016889E-004 DAV: 21 -0.102321647894E+03 -0.12259E-01 -0.12178E-01 120 0.598E-02 0.140E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.275090927361583E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.275090927361583E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.457893240949717E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 3.431199597317909E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 3.639374451336095E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -5.166937168468751E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.457893240949717E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 3.431199597317909E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 3.639374451336095E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -5.166937168468751E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.760788553744479E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.760788553744479E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -3.562726500692326E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.117992310730482E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.526724423628682E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.466047219082817E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.192894030784924E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.703922506850723E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -6.820466782463465E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -3.562726500692326E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.117992310730482E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.526724423628682E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.466047219082817E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.192894030784924E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.703922506850723E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -6.820466782463465E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -4.335080438033955E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -4.335080438033955E-004 DAV: 22 -0.511831732622E+03 -0.40951E+03 -0.40948E+03 104 0.150E+00 0.465E+01 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.466616528487820E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.034955937586651E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.466616528487820E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.034955937586651E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.951822494602396E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.179522934823315E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.198395711311932E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -5.808609282975832E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -3.072634696194271E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.127119216193758E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.516081513732786E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -2.320510380543216E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.951822494602396E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.179522934823315E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.198395711311932E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -5.808609282975832E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -3.072634696194271E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.127119216193758E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.516081513732786E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -2.320510380543216E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 7.504988483416634E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.058741690798076E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -1.026824153031663E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -2.421015666878918E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.968219292965502E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.595696711336344E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.878090819047222E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 7.504988483416634E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.058741690798076E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -1.026824153031663E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -2.421015666878918E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.968219292965502E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.595696711336344E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.878090819047222E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.469147467863690E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.510557613956858E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 4.406607289069627E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 4.814513350853442E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 4.378233942520998E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.985097454115061E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.469147467863690E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.510557613956858E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 4.406607289069627E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 4.814513350853442E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 4.378233942520998E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.985097454115061E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.260740947702157E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 9.608462175530543E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.260740947702157E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 9.608462175530543E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 5.237562719272424E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 5.237562719272424E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 8.650383477090512E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 8.650383477090512E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -9.196374979965247E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -9.196374979965247E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.664012809604656E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.174264346540743E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.445113819313044E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -9.606065314650374E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.664012809604656E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.174264346540743E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.445113819313044E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -9.606065314650374E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -3.816016196880480E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -3.816016196880480E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.631951794465670E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.941148547989530E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.631951794465670E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.941148547989530E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 5.436048575881768E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.730482466552918E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 5.436048575881768E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 4.730482466552918E-004 DAV: 23 -0.101368993501E+03 0.41046E+03 -0.87755E+02 80 0.539E+01 0.201E+00 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 6.660695327717975E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 9.154351314635730E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 9.032894620038191E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.783471401644954E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 8.166741915413712E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.264220708241183E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -7.814356315472847E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -2.691582719582525E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 6.660695327717975E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 9.154351314635730E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 9.032894620038191E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.783471401644954E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 8.166741915413712E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 5.264220708241183E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -7.814356315472847E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -2.691582719582525E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 8.994559948379608E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 8.994559948379608E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.626941987696620E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -2.230187700778440E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -3.626941987696620E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -2.230187700778440E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -8.951651706186979E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.268561968190042E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -8.951651706186979E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.268561968190042E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 3.686413812126526E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -8.270974149009504E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -1.093104111457406E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.888824602275975E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 3.686413812126526E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -8.270974149009504E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -1.093104111457406E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.888824602275975E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.012845404184767E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.487136191124469E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.513769509128864E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -5.785227329833166E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.025578075308519E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.012845404184767E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.487136191124469E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.513769509128864E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -5.785227329833166E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.025578075308519E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.095572227785544E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -3.953864934778329E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -3.848555027024129E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -8.688535458125670E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.418764880841279E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.095572227785544E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -3.953864934778329E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -3.848555027024129E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -8.688535458125670E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.418764880841279E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.331826403406359E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.331826403406359E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -5.444949392359759E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -5.444949392359759E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -2.421226277330951E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.609185799950181E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -2.421226277330951E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.609185799950181E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.164983418103514E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.164983418103514E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -3.261723849236764E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -6.078730923951482E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -3.261723849236764E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -6.078730923951482E-004 DAV: 24 -0.102299433578E+03 -0.93044E+00 -0.87024E+00 86 0.524E+00 0.649E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.304496974239040E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 7.999558425580432E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.510504638593596E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.694281432256811E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 7.840157499937793E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 6.473893112552813E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.009146111599641E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.207129908046173E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.304496974239040E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 7.999558425580432E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.510504638593596E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.694281432256811E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 7.840157499937793E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 6.473893112552813E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.009146111599641E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.207129908046173E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.346457486343341E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.893371667367788E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 9.346457486343341E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.893371667367788E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.874221173146290E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.386844257797709E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.874221173146290E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.386844257797709E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.275216151380709E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.275216151380709E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.715609780596817E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -2.540943972678732E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -8.558593337257051E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.281544056821488E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.715609780596817E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -2.540943972678732E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -8.558593337257051E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.281544056821488E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.376519561262554E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.037551882113422E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -2.541145704195576E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.422047984727754E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.376519561262554E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.037551882113422E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -2.541145704195576E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.422047984727754E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -7.623402842390718E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -5.539381485135716E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -7.623402842390718E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -5.539381485135716E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 7.633686741676001E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -5.943160281083054E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 7.633686741676001E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -5.943160281083054E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.398777448667904E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.398777448667904E-004 DAV: 25 -0.102351796373E+03 -0.52363E-01 -0.19600E-01 104 0.117E+00 0.287E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.984169947816700E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.984169947816700E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.625689984481451E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.625689984481451E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.839280334022719E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.568332345816352E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -1.751024473139262E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.839280334022719E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 4.568332345816352E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -1.751024473139262E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.273889712403933E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.273889712403933E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.884954728325505E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -6.859918378536028E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.554831572416509E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.884954728325505E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -6.859918378536028E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.554831572416509E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 9.489000814030554E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.408325815707502E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.935913087606755E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.667682987438123E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.236494040910619E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 9.489000814030554E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.408325815707502E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.935913087606755E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.667682987438123E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.236494040910619E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.325007438027278E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -5.257060133127326E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -2.325007438027278E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -5.257060133127326E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -6.262065132637049E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -6.262065132637049E-005 DAV: 26 -0.102354031071E+03 -0.22347E-02 0.22151E-01 80 0.156E+00 0.258E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.739511111069425E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.739511111069425E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.606858862923852E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.606858862923852E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.330123113893853E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -3.054564354371671E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.741200880305387E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -4.223511090638792E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.330123113893853E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -3.054564354371671E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.741200880305387E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -4.223511090638792E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.279205865739698E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.129197891424141E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.279205865739698E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.129197891424141E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -4.502898636380568E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -5.525996402058575E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.318678576771767E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.307788676515243E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -4.502898636380568E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -5.525996402058575E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -3.318678576771767E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -2.307788676515243E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 8.554621077776903E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.205614311064830E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.088476466783889E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.079768117199978E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 8.554621077776903E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.205614311064830E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.088476466783889E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.079768117199978E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.569099811725996E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.569099811725996E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -3.541515089402348E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -4.109716541323288E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -3.541515089402348E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -4.109716541323288E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 7.401555754321356E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 7.831240757780865E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 7.401555754321356E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 7.831240757780865E-005 DAV: 27 -0.102406840194E+03 -0.52809E-01 -0.14623E-01 120 0.371E-01 0.480E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.995129789895434E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 3.995129789895434E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.536919851565797E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.536919851565797E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.281528638086877E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.207492075560645E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.281528638086877E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.207492075560645E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 6.117023324534641E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.068047604984468E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.654095250837631E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.806665008322799E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 5.477695957497328E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 5.968922224089178E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 6.117023324534641E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.068047604984468E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 1.654095250837631E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.806665008322799E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 5.477695957497328E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 5.968922224089178E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 7.660228522011277E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.151568971994563E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.180095238111760E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.915869531820052E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 7.660228522011277E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.151568971994563E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -3.180095238111760E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.915869531820052E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -9.209515751596677E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.509485125290279E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.479306564531164E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -9.209515751596677E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 2.509485125290279E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -8.479306564531164E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 6.472428516745650E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.571888400248273E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 6.472428516745650E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.571888400248273E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.101891731792278E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.101891731792278E-004 DAV: 28 -0.102406586804E+03 0.25339E-03 0.25083E-01 88 0.326E+00 0.338E-01 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -3.196472170528221E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -6.936370905151737E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -7.168260565540553E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -1.053454894293156E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -6.828106792724700E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -8.193986831588431E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.818854722408588E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.521980982515296E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -3.196472170528221E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -6.936370905151737E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -7.168260565540553E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -1.053454894293156E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -6.828106792724700E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -8.193986831588431E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.818854722408588E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -1.521980982515296E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -1.528565970577324E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.628371927403090E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -1.528565970577324E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.628371927403090E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.424808164766756E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -8.424808164766756E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 9.364274952710798E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.652135287117239E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 6.310040136726786E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.532951438972721E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 6.380044048948195E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 8.710593867929332E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.451046898672819E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.942954969387410E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 9.364274952710798E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.652135287117239E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 6.310040136726786E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 7.532951438972721E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 6.380044048948195E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 8.710593867929332E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.451046898672819E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 2.942954969387410E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.525118355942508E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 4.187423207824601E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -6.153721180008102E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 7.869259543159717E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 2.869006333849542E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.495562808176594E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.525118355942508E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 4.187423207824601E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -6.153721180008102E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 7.869259543159717E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 2.869006333849542E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.495562808176594E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -4.520530515231836E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 5.224424719298955E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 6.434740738711402E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -8.326525713491047E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -4.520530515231836E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 5.224424719298955E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 6.434740738711402E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -8.326525713491047E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 5.021691976201426E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.566985963155275E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -2.518403818273259E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 5.021691976201426E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.566985963155275E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -2.518403818273259E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.280304308199794E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.185447860445418E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.280304308199794E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.185447860445418E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.249922393065479E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.814996124919550E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.107676572361464E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.401801946524747E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.200954485074998E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 2.086440461452595E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.203478512082157E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 7.593644642990146E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.249922393065479E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -1.814996124919550E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.107676572361464E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 1.401801946524747E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.200954485074998E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 2.086440461452595E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.203478512082157E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 7.593644642990146E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.404855894833367E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.218102022831110E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 3.391337398881241E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.626075952994956E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.878393991467795E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.300198884343851E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.613026090688352E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.096460077290519E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.404855894833367E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.218102022831110E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 3.391337398881241E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.626075952994956E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.878393991467795E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 3.300198884343851E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 1.613026090688352E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.096460077290519E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 6.727872755336690E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 9.951650114853274E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.203436682036376E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 6.781381504897576E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 7.395727579643342E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 9.734575679734110E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 6.689735801791112E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 2.130979206797131E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 6.727872755336690E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 9.951650114853274E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.203436682036376E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 6.781381504897576E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 7.395727579643342E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 9.734575679734110E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 6.689735801791112E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 2.130979206797131E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.956069729070984E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 4.493517872920866E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 4.882976119843997E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 3.116358171508521E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 3.336122488873023E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.056297348902502E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.075623838957821E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -4.056071608992615E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.956069729070984E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 4.493517872920866E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 4.882976119843997E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 3.116358171508521E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 3.336122488873023E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 4.056297348902502E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.075623838957821E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -4.056071608992615E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 8.227252463674422E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.202957033466523E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.837672049885468E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.144832786298499E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 8.227252463674422E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 1.202957033466523E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.837672049885468E-005 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 4.144832786298499E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.671577781496049E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.766590649719861E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 8.701174485765262E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -1.961894754173881E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -2.328136709734268E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.485883203948454E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 3.554486973123144E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -4.003180628694898E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.671577781496049E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 3.766590649719861E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 8.701174485765262E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -1.961894754173881E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -2.328136709734268E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -4.485883203948454E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 3.554486973123144E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -4.003180628694898E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.687587432167423E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 3.044807634848488E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 4.094569812708490E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.196593457598655E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.614188000953568E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.059844260660238E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -2.382457823252910E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 3.526739184689012E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 8.687587432167423E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 3.044807634848488E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 4.094569812708490E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 1.196593457598655E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 1.614188000953568E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.059844260660238E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -2.382457823252910E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 3.526739184689012E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 5.442994677487807E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 8.535113789266777E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -1.188550153089202E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.943154074865858E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.237781486918570E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 1.378373192405627E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -2.457710261095509E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 2.031563959474932E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 5.442994677487807E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 8.535113789266777E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -1.188550153089202E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.943154074865858E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.237781486918570E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 1.378373192405627E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -2.457710261095509E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 2.031563959474932E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.093192935979772E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.304447607912844E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 4.380075843459361E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.811229010222039E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 2.080947522555164E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.656647089102769E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -4.647224448422078E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -6.670899022948541E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 2.093192935979772E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.304447607912844E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 4.380075843459361E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.811229010222039E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 2.080947522555164E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.656647089102769E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -4.647224448422078E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -6.670899022948541E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 1.423157854538097E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.158654949285936E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 1.423157854538097E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -1.158654949285936E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 4.273980707452861E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.293894476805655E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 4.273980707452861E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 1.293894476805655E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 3.108855898134743E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.341349494865102E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 3.108855898134743E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.341349494865102E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.415016865840137E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.868163130084260E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 2.415016865840137E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.868163130084260E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.293743157533275E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -5.339740581719454E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -1.293743157533275E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -5.339740581719454E-004 DAV: 29 -0.856988902114E+04 -0.84675E+04 -0.83080E+04 136 0.564E-01BRMIX: very serious problems the old and the new charge density differ old charge density: 45.00000 new 45.06544 0.892E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.811193315139162 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -3.844078364695325E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.166665095470838 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.223774539439413 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 9.398041173058709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.201453539572277 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.183633667321958 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -6.329688802572657E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.811193315139162 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -3.844078364695325E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.166665095470838 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.223774539439413 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 9.398041173058709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.201453539572277 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.183633667321958 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -6.329688802572657E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.456853082229655 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.179967146249688 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.397017137564516 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.487645767829614 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.359460044421053 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.420056691807251 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.461266541650031E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.144213448307856E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.456853082229655 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.179967146249688 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.397017137564516 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.487645767829614 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.359460044421053 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.420056691807251 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 1.461266541650031E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.144213448307856E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.173534668611088 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 5.026268280229145E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.136407032194298 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.210382299083285 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -5.021645370793186E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -3.271999551700310E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.311872949515474 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 7.535611493261812E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.173534668611088 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 5.026268280229145E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.136407032194298 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.210382299083285 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -5.021645370793186E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -3.271999551700310E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.311872949515474 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 7.535611493261812E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.213800927028058 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.394344720943027 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -7.215053359618602E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -9.131299022339774E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.084823929077243E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -2.649264774461561E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -1.021634887910898E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -5.260394181451546E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.213800927028058 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.394344720943027 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -7.215053359618602E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -9.131299022339774E-004 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -1.084823929077243E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -2.649264774461561E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -1.021634887910898E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -5.260394181451546E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 9.230155162250775E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.425209814270995 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.094657318065633E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -6.972815087916341E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.395688864715182E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -1.702190648021818E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -2.127228485201999E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -3.255374066814574E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 9.230155162250775E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.425209814270995 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.094657318065633E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -6.972815087916341E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.395688864715182E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -1.702190648021818E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -2.127228485201999E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -3.255374066814574E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 4.507749382631152E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.177047008700299 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 2.039513246784887E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -1.574840329753657E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.711500470498947E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.880193763406919E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -9.676916032256613E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.100012646525439 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 4.507749382631152E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.177047008700299 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 2.039513246784887E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -1.574840329753657E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -1.711500470498947E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.880193763406919E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -9.676916032256613E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.100012646525439 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.847858461969736E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 5.292030800379408E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.005531121630387E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.091848547726700E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.123392642935103E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.087924386573427E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 5.101161393456671E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -5.862180900337743E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.847858461969736E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 5.292030800379408E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 1.005531121630387E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.091848547726700E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 2.123392642935103E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 3.087924386573427E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 5.101161393456671E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -5.862180900337743E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.130659733710000 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 8.886656359369097E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 3.960360480485280E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 3.692006122618251E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 4.525821924060637E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 3.418181608442037E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.218312628996015E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.218183786606033 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.130659733710000 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 8.886656359369097E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 3.960360480485280E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 3.692006122618251E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 4.525821924060637E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 3.418181608442037E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.218312628996015E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.218183786606033 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.146376890330404 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -2.358118506362464E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.537624360836734E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.664585974884243E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.720626486005893E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 2.895548569466314E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -7.650044576786329E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.703952625608038E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.146376890330404 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -2.358118506362464E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.537624360836734E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.664585974884243E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 2.720626486005893E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 2.895548569466314E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -7.650044576786329E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -3.703952625608038E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -5.707789594200570E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -4.841218169507092E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 2.643689026264693E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 1.328443241411841E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.701523062304968E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 2.106849836477914E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.072161809276063E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -7.548855941869321E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -5.707789594200570E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -4.841218169507092E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 2.643689026264693E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 1.328443241411841E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 1.701523062304968E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 2.106849836477914E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.072161809276063E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -7.548855941869321E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -2.356903416575785E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -3.759562470218768E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.879728320837677E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 9.428986533060036E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.279461779910248E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.553301270267945E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.222607326147075E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.042919067515485E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -2.356903416575785E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -3.759562470218768E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.879728320837677E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 9.428986533060036E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 1.279461779910248E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.553301270267945E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 1.222607326147075E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.042919067515485E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -2.416545668746559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -9.314555238785362E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 3.820499166499296E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.127384914335321 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 5.342941556160596E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.170504649084741 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 3.822263128351894E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.355391556827448 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -2.416545668746559E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -9.314555238785362E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 3.820499166499296E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.127384914335321 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 5.342941556160596E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.170504649084741 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 3.822263128351894E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.355391556827448 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.207203531953745 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.230410431110233 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.102920240629966 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.125323973814157E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.326564005728231 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.359009005061688 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.435196165363107E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.235093620894816 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.207203531953745 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.230410431110233 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.102920240629966 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 5.125323973814157E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.326564005728231 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.359009005061688 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -8.435196165363107E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.235093620894816 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -4.600448349721549E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -3.758622416322709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 3.643898410933288E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 7.330395891641679E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.331509680340761 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.323370112979411 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.137974356919695 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.332570731773566 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -4.600448349721549E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -3.758622416322709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 3.643898410933288E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 7.330395891641679E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.331509680340761 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.323370112979411 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.137974356919695 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.332570731773566 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -1.759816063860503E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -2.284876171503583E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 5.168922892502353E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.373887626598878E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.226233465817000 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.328447831561113 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.222064794311943 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.294758446649292 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -1.759816063860503E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -2.284876171503583E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 5.168922892502353E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 5.373887626598878E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.226233465817000 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.328447831561113 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -0.222064794311943 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.294758446649292 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -6.979169967870952E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.392465875779810E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 2.334130314257907E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.908733717715726E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.128913903364415 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.121369689213095 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -4.534291583209422E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -9.740062431566453E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -6.979169967870952E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.392465875779810E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 2.334130314257907E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 2.908733717715726E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.128913903364415 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.121369689213095 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -4.534291583209422E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -9.740062431566453E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -2.371731920189593E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.126145399630792 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -2.371731920189593E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.126145399630792 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.676790107260598E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.146283587007563 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -6.676790107260598E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.146283587007563 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.174173743098234 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.191951303285662 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.174173743098234 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.191951303285662 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.169521619515102 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.234150519701988 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.169521619515102 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.234150519701988 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.141483931648257 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.227616373149142 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.141483931648257 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.227616373149142 DAV: 30 -0.205990644517E+05 -0.12029E+05 -0.20033E+05 104 0.356E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 45.06544 new 44.31675 0.629E+02 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.463856160819511 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.417333330922711 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.523901219134574 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.846675619849429 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.252866276826756 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.721364003238397 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.280728103718636 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.29331151571392 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.463856160819511 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.417333330922711 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.523901219134574 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.846675619849429 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.252866276826756 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.721364003238397 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.280728103718636 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 1.29331151571392 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.909410735021551 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.786617865431716 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.236853575787144 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.31218324078705 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.27003792661951 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.306850982380883 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.278250459776945 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.909410735021551 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.786617865431716 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.236853575787144 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.31218324078705 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -1.27003792661951 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.306850982380883 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.278250459776945 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -4.049873045908326E-002 -4.049873045908326E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.656581428959483 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.638493978626980 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.134441651067545E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.442123656182175 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.726679381033178 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.101335589932520 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.342603843180189 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -8.295692348707688E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 0.656581428959483 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.638493978626980 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -1.134441651067545E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.442123656182175 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.726679381033178 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.101335589932520 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.342603843180189 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -8.295692348707688E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.112345918044985 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -2.040632558208657E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.269382276533201 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.676450983218953 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.271360186266254E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.442715202776340E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.227663913689817 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 5.078323321989540E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.112345918044985 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -2.040632558208657E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.269382276533201 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.676450983218953 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -4.271360186266254E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 2.442715202776340E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.227663913689817 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 5.078323321989540E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.923060077230926E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.756957042560308E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.158282263686617 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.279804055342016 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.121535159887934 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -6.462546869037401E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -2.706403002770007E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.612653045709226 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 4.923060077230926E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.756957042560308E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.158282263686617 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.279804055342016 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.121535159887934 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -6.462546869037401E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -2.706403002770007E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.612653045709226 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.727538750767719E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.179808936119336 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.213788346089673 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.498822314434293 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -8.820174392664129E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.790386758432770E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.116324013405185 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.164792715346947 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -1.727538750767719E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.179808936119336 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.213788346089673 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.498822314434293 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -8.820174392664129E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -1.790386758432770E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.116324013405185 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.164792715346947 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -4.485838233570890E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.699102193477712E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.129565910699501 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.254853171806156 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -7.174253071843942E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 7.720584756345205E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -5.741400072429562E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.111345472132311 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -4.485838233570890E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 3.699102193477712E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.129565910699501 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -0.254853171806156 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -7.174253071843942E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 7.720584756345205E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -5.741400072429562E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.111345472132311 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -2.423901007201268E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.561922463534493E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.109758987622826 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.188441387770824 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -4.731984064312701E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.056516120158535E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -6.251932888276954E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -5.512617434917066E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -2.423901007201268E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 2.561922463534493E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.109758987622826 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.188441387770824 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -4.731984064312701E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 1.056516120158535E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -6.251932888276954E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -5.512617434917066E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.483240128817709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 7.849252301387219E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.004392086655865E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.152913617135258 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.117954860773498 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 5.332209696760908E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.994543170505479E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.065967349528131E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.483240128817709E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 7.849252301387219E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.004392086655865E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.152913617135258 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.117954860773498 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 5.332209696760908E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.994543170505479E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.065967349528131E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 5.611373943732581E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.146491985780984 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.329067832240633 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.664025702467911 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.304814535207662 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.190368147573721 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.960019388564251E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -3.018417845699366E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 5.611373943732581E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.146491985780984 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.329067832240633 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 0.664025702467911 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.304814535207662 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.190368147573721 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 -1.960019388564251E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -3.018417845699366E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.435952406037431E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 3.044164643973475E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -8.050420528515144E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.489010135157771 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.227233748057092 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.162301814126192 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 5.505784581707871E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -2.589725261451811E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 5.435952406037431E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 3.044164643973475E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -8.050420528515144E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 0.489010135157771 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.227233748057092 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.162301814126192 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 5.505784581707871E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -2.589725261451811E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 8.082679361829188E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 8.305841804172491E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 6.663880351550742E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.238462074835818 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -3.095783555239159E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.113732026845674 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 8.259771859461883E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.057332863061945E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 8.082679361829188E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 8.305841804172491E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 6.663880351550742E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.238462074835818 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -3.095783555239159E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.113732026845674 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 8.259771859461883E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.057332863061945E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 6.310461513256772E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 7.511972802039776E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 7.405255751764049E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.128327405520527 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 7.033341996965257E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 5.085609990731012E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.163086836320841E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.542279868570403E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 6.310461513256772E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 7.511972802039776E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 7.405255751764049E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.128327405520527 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 7.033341996965257E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 5.085609990731012E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 3.163086836320841E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.542279868570403E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.223465954365371E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 9.592295869443490E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.107644848709881 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.898626563619071E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.445132253719848E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 5.272998383435291E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.297756732458808 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.859998521454050E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 4.223465954365371E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 9.592295869443490E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.107644848709881 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.898626563619071E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -5.445132253719848E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 5.272998383435291E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.297756732458808 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -1.859998521454050E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.108913266400452 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.757397147113467 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.619609538989923 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.718571467605177 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.189126948195512 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.106634638626761 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.210917884234718 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 5.825329112703149E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 0.108913266400452 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.757397147113467 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.619609538989923 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.718571467605177 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 0.189126948195512 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.106634638626761 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.210917884234718 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 5.825329112703149E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.120675218043893 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.175863212881332 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.692446409015278 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.292804438350010 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.469106761545383 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.104397594308510 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -9.279884541189368E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.211158948530455 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.120675218043893 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 0.175863212881332 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 0.692446409015278 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.292804438350010 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 0.469106761545383 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.104397594308510 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -9.279884541189368E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 0.211158948530455 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.117145907257786 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 4.177225287566645E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 0.373016793682746 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 8.798036478749359E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.884623341361672 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.112915523626611 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.225133497020275 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.224695418478917 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.117145907257786 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 4.177225287566645E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 0.373016793682746 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 8.798036478749359E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 0.884623341361672 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.112915523626611 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 0.225133497020275 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.224695418478917 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 9.770775212160344E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.153599275518716 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 0.102311275853472 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.183931020242966 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.381849414847816 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.463949020229492 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -3.457164906739813E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.152314316294730 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 9.770775212160344E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.153599275518716 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 0.102311275853472 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -0.183931020242966 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 0.381849414847816 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.463949020229492 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -3.457164906739813E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 0.152314316294730 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.317494618511770 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.314470533471621 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.317494618511770 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 0.314470533471621 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.762414952477570 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.313196400590389 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.762414952477570 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.313196400590389 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.01868851443414 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.432925878220236 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 1.01868851443414 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.432925878220236 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.11854531783605 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.722485235427089E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 1.11854531783605 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 2.722485235427089E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.14194527225555 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.295115194431259E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.14194527225555 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.295115194431259E-002 DAV: 31 -0.161354008406E+05 0.44637E+04 -0.12354E+05 120 0.255E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 44.31675 new 46.17090 0.151E+03 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.658810023794971 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 4.806781117017771E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.21272291374276 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.235137406279547 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.215887552905829 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.692658222245886 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -1.656644068844451E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.114918429083610 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.658810023794971 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 4.806781117017771E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.21272291374276 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.235137406279547 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.215887552905829 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.692658222245886 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -1.656644068844451E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.114918429083610 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.09738750899218 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.259619563604241 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.25152810001012 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.429143906671788 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -2.75016686513918 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.748370564545322 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.24562256458589 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.200021092154256 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 2.09738750899218 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 0.259619563604241 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.25152810001012 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.429143906671788 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 -2.75016686513918 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.748370564545322 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 2.24562256458589 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.200021092154256 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.16988073748653 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -5.907808407148113E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.42091154847894 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.467314635098698 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -2.18707760621746 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.173412809200811E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 2.885720547092579E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.63196701356977 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.16988073748653 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -5.907808407148113E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 1.42091154847894 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.467314635098698 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -2.18707760621746 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 1.173412809200811E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 2.885720547092579E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 1.63196701356977 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.658797032192909 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.595641244577304 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.42725442045823 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.594661137892702 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -1.69400917246703 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.719572245921431 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.335230258726151E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.50881597084787 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.658797032192909 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -0.595641244577304 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 1.42725442045823 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 0.594661137892702 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -1.69400917246703 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.719572245921431 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 1.335230258726151E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 1.50881597084787 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.393842293829026 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.24460904574189 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.51921452950950 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.24262721540442 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -0.410338036807868 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.866833574766791 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -0.177355817133795 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.37375440274431 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 0.393842293829026 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 -1.24460904574189 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 1.51921452950950 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 1.24262721540442 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -0.410338036807868 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.866833574766791 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -0.177355817133795 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 1.37375440274431 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.611925883979429 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.241013731712444 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.611882515374025 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.546358048274583 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.611925883979429 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 -0.241013731712444 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 0.611882515374025 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.546358048274583 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.906991792248237 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.515086203239757 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.833644115845518 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 6.493336867005514E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 0.906991792248237 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -0.515086203239757 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -0.833644115845518 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 6.493336867005514E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.710010357978240 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.51607069749343 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.545066861774749 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.876066194134101 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.21266409785318 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.551225783909764 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.512338931271800 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.52126881399693 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.710010357978240 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 2.51607069749343 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -0.545066861774749 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.876066194134101 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 1.21266409785318 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.551225783909764 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.512338931271800 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 1.52126881399693 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.74170274185189 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.42473585849102 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.257693350342877 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.121311843415740 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -8.862071447008867E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.333277194141131 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.25926532337895 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.981925051982313 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 1.74170274185189 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.42473585849102 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.257693350342877 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -0.121311843415740 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -8.862071447008867E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 -0.333277194141131 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -1.25926532337895 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -0.981925051982313 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.555940677818690 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 0.817453586514324 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.453451621879133 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -8.291819898775842E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -0.236547546322633 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.788504197760641 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -1.83253277517451 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.173599066634827 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 0.555940677818690 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 0.817453586514324 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.453451621879133 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -8.291819898775842E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -0.236547546322633 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 -0.788504197760641 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 -1.83253277517451 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 0.173599066634827 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -0.241420858954654 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 8.876644476423638E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.272910555063500 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -8.516062110462808E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -4.987998817711238E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.944853880617215 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -1.94466755037268 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -3.844334583928241E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -0.241420858954654 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 8.876644476423638E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.272910555063500 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 -8.516062110462808E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -4.987998817711238E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 -0.944853880617215 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 -1.94466755037268 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -3.844334583928241E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.103230420701633 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.631239578672985E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.027521937436071E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.270136240222682 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -8.300731611471827E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.202254592567311E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -8.590058609052492E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.207552606714943 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.103230420701633 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 3.631239578672985E-003 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -2.027521937436071E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 -0.270136240222682 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -8.300731611471827E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 -1.202254592567311E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 -8.590058609052492E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 0.207552606714943 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.572519794145679 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.206519309817693 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.31614243633648 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.697350110119522 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.73310542285530 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.167095437444611 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.135887787986947 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.143394599426566 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 -0.572519794145679 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 -0.206519309817693 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 -1.31614243633648 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 -0.697350110119522 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 2.73310542285530 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 0.167095437444611 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 0.135887787986947 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 0.143394599426566 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.443135981551826 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.248985028250364 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.252489563977785 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -2.05353895353546 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.199461618098429 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.892606426144796 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.138096260818066 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.79965829102190 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 -0.443135981551826 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 -0.248985028250364 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 -0.252489563977785 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 -2.05353895353546 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 -0.199461618098429 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 0.892606426144796 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 -0.138096260818066 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 -1.79965829102190 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -0.138765631932675 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -5.202091712959043E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.155792990725779 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -9.359378890720707E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -0.750390163308970 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.405737333303654 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 7.639269207896486E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.495130458237184 WARNING: Sub-Space-Matrix is not hermitian in DAV 25 -0.138765631932675 WARNING: Sub-Space-Matrix is not hermitian in DAV 26 -5.202091712959043E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 27 -0.155792990725779 WARNING: Sub-Space-Matrix is not hermitian in DAV 28 -9.359378890720707E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 29 -0.750390163308970 WARNING: Sub-Space-Matrix is not hermitian in DAV 30 0.405737333303654 WARNING: Sub-Space-Matrix is not hermitian in DAV 31 7.639269207896486E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 32 -0.495130458237184 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -5.048648901862736E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.534506448498083 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.147793784185503 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.684386532527157 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -0.764510670873255 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.170497943671237 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.229594843544179 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -0.762440814589704 WARNING: Sub-Space-Matrix is not hermitian in DAV 33 -5.048648901862736E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 34 0.534506448498083 WARNING: Sub-Space-Matrix is not hermitian in DAV 35 -0.147793784185503 WARNING: Sub-Space-Matrix is not hermitian in DAV 36 0.684386532527157 WARNING: Sub-Space-Matrix is not hermitian in DAV 37 -0.764510670873255 WARNING: Sub-Space-Matrix is not hermitian in DAV 38 0.170497943671237 WARNING: Sub-Space-Matrix is not hermitian in DAV 39 0.229594843544179 WARNING: Sub-Space-Matrix is not hermitian in DAV 40 -0.762440814589704 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.201810731499845E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.685446720235697E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.266281427791974 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.105139094168601 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.159052421555164 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.132109203186148 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.698982618954546 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.147376787263933 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -1.201810731499845E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 2.685446720235697E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.266281427791974 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 0.105139094168601 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.159052421555164 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.132109203186148 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.698982618954546 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 -0.147376787263933 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.69900723130762 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.76092460245180 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.561786443100442 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.669423644957155E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.85897103528438 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.781113416229099 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 14.2044030976440 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.652604011332672 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 1.69900723130762 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 1.76092460245180 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 0.561786443100442 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 2.669423644957155E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 3.85897103528438 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 -0.781113416229099 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 14.2044030976440 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 -0.652604011332672 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 12.1641702693694 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.52660136247056 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 6.12179868787701 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.07630320887700 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 16.1512049719390 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 20.1331037753076 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 27.2733152428734 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 9.16500883508101 WARNING: Sub-Space-Matrix is not hermitian in DAV 17 12.1641702693694 WARNING: Sub-Space-Matrix is not hermitian in DAV 18 2.52660136247056 WARNING: Sub-Space-Matrix is not hermitian in DAV 19 6.12179868787701 WARNING: Sub-Space-Matrix is not hermitian in DAV 20 2.07630320887700 WARNING: Sub-Space-Matrix is not hermitian in DAV 21 16.1512049719390 WARNING: Sub-Space-Matrix is not hermitian in DAV 22 20.1331037753076 WARNING: Sub-Space-Matrix is not hermitian in DAV 23 27.2733152428734 WARNING: Sub-Space-Matrix is not hermitian in DAV 24 9.16500883508101 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.332175134410516 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.751943787525147E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 -0.332175134410516 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 1.751943787525147E-002 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.207334630890091 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.09734156096121 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -0.207334630890091 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 2.09734156096121 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 49.2228038721821 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 54.0562664127362 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 49.2228038721821 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 54.0562664127362 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 46.8242116287838 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 66.6502738105140 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 46.8242116287838 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 66.6502738105140 DAV: 32 -0.100596816270E+06 -0.84461E+05 -0.10098E+06 118 0.352E+02BRMIX: very serious problems the old and the new charge density differ old charge density: 46.17090 new 45.85832 0.223E+03 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.643201396373170 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 13.1111432951546 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.47020597212922 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 105.901629985351 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.279650847224036 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.155486737258205 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.744754581881011 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 8.18625509680189 WARNING: Sub-Space-Matrix is not hermitian in DAV 1 0.643201396373170 WARNING: Sub-Space-Matrix is not hermitian in DAV 2 13.1111432951546 WARNING: Sub-Space-Matrix is not hermitian in DAV 3 -1.47020597212922 WARNING: Sub-Space-Matrix is not hermitian in DAV 4 105.901629985351 WARNING: Sub-Space-Matrix is not hermitian in DAV 5 -0.279650847224036 WARNING: Sub-Space-Matrix is not hermitian in DAV 6 0.155486737258205 WARNING: Sub-Space-Matrix is not hermitian in DAV 7 0.744754581881011 WARNING: Sub-Space-Matrix is not hermitian in DAV 8 8.18625509680189 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 189.901050125999 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 474.322844553233 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 18.5121670591899 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 3860.25733645112 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 34.8060028979797 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 201.613640592252 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 13.7322750810681 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 521.856497440331 WARNING: Sub-Space-Matrix is not hermitian in DAV 9 189.901050125999 WARNING: Sub-Space-Matrix is not hermitian in DAV 10 474.322844553233 WARNING: Sub-Space-Matrix is not hermitian in DAV 11 18.5121670591899 WARNING: Sub-Space-Matrix is not hermitian in DAV 12 3860.25733645112 WARNING: Sub-Space-Matrix is not hermitian in DAV 13 34.8060028979797 WARNING: Sub-Space-Matrix is not hermitian in DAV 14 201.613640592252 WARNING: Sub-Space-Matrix is not hermitian in DAV 15 13.7322750810681 WARNING: Sub-Space-Matrix is not hermitian in DAV 16 521.856497440331 ----------------------------------------------------------------------------- | | | 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 = 9 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-task36959" 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 *****************************