N E dE d eps ncg rms rms(c) DAV: 1 0.326592218563E+04 0.32659E+04 -0.23723E+05 9112 0.122E+03 DAV: 2 -0.569375592693E+03 -0.38353E+04 -0.37467E+04 10948 0.319E+02 DAV: 3 -0.888844761161E+03 -0.31947E+03 -0.31720E+03 10680 0.996E+01 DAV: 4 -0.895823946382E+03 -0.69792E+01 -0.69518E+01 10824 0.152E+01 DAV: 5 -0.896014139796E+03 -0.19019E+00 -0.18987E+00 10600 0.234E+00 0.760E+01 DAV: 6 -0.797789870792E+03 0.98224E+02 -0.40947E+02 10080 0.336E+01 0.358E+01 DAV: 7 -0.796416922317E+03 0.13729E+01 -0.18351E+01 11408 0.775E+00 0.145E+01 DAV: 8 -0.795949005779E+03 0.46792E+00 -0.21967E+00 10632 0.362E+00 0.575E+00 DAV: 9 -0.795929540140E+03 0.19466E-01 -0.43329E-01 10632 0.165E+00 0.115E+00 DAV: 10 -0.795945789096E+03 -0.16249E-01 -0.10821E-01 10752 0.842E-01 0.695E-01 DAV: 11 -0.795948283976E+03 -0.24949E-02 -0.22361E-02 10592 0.420E-01 0.343E-01 DAV: 12 -0.795948497883E+03 -0.21391E-03 -0.57620E-03 10464 0.248E-01 0.118E-01 DAV: 13 -0.795947850165E+03 0.64772E-03 -0.20174E-03 11680 0.192E-01 0.713E-02 DAV: 14 -0.795947761243E+03 0.88922E-04 -0.16606E-03 10616 0.109E-01 0.703E-02 DAV: 15 -0.795947656592E+03 0.10465E-03 -0.17600E-04 10416 0.341E-02 0.440E-02 DAV: 16 -0.795947572572E+03 0.84019E-04 -0.15130E-04 10616 0.488E-02 0.146E-02 DAV: 17 -0.795947566321E+03 0.62510E-05 -0.83975E-05 10392 0.268E-02 1 F= -.79594757E+03 E0= -.79594757E+03 d E =0.000000E+00 Linear response reoptimize wavefunctions DAV: 1 -0.795947566012E+03 0.30905E-06 -0.31797E-05 10280 0.134E-02 DAV: 2 -0.795947566262E+03 -0.24957E-06 -0.24956E-06 10576 0.292E-03 DAV: 3 -0.795947566265E+03 -0.25466E-08 -0.25548E-08 6632 0.318E-04 Linear response G [H, r] |phi>, progress : Direction: 1 N E dE d eps ncg rms RMM: 1 -0.213498939948E+04 -0.21350E+04 0.13387E+03 21603 0.111E+02 RMM: 2 -0.191859474281E+04 0.21639E+03 -0.23885E+02 15380 0.240E+01 RMM: 3 -0.192154088134E+04 -0.29461E+01 -0.80513E+00 15532 0.384E+00 RMM: 4 -0.192176836654E+04 -0.22749E+00 -0.31770E-01 15916 0.737E-01 RMM: 5 -0.192177818797E+04 -0.98214E-02 -0.31790E-02 15920 0.177E-01 RMM: 6 -0.192177922480E+04 -0.10368E-02 -0.41924E-03 15935 0.580E-02 RMM: 7 -0.192177933806E+04 -0.11326E-03 -0.30173E-03 16131 0.390E-02 RMM: 8 -0.192177934971E+04 -0.11653E-04 -0.28985E-03 16189 0.358E-02 RMM: 9 -0.192177935394E+04 -0.42243E-05 -0.29678E-03 16213 0.355E-02 Linear response G [H, r] |phi>, progress : Direction: 2 N E dE d eps ncg rms RMM: 1 -0.214263267346E+04 -0.21426E+04 0.12568E+03 21835 0.111E+02 RMM: 2 -0.191611369135E+04 0.22652E+03 -0.24888E+02 15352 0.245E+01 RMM: 3 -0.191919866390E+04 -0.30850E+01 -0.84217E+00 15560 0.390E+00 RMM: 4 -0.191943588509E+04 -0.23722E+00 -0.34011E-01 15926 0.748E-01 RMM: 5 -0.191944636856E+04 -0.10483E-01 -0.33651E-02 15920 0.179E-01 RMM: 6 -0.191944746587E+04 -0.10973E-02 -0.41111E-03 15956 0.588E-02 RMM: 7 -0.191944757793E+04 -0.11206E-03 -0.26889E-03 16098 0.392E-02 RMM: 8 -0.191944759202E+04 -0.14086E-04 -0.25889E-03 16231 0.359E-02 RMM: 9 -0.191944759705E+04 -0.50333E-05 -0.25709E-03 16239 0.355E-02 RMM: 10 -0.191944761418E+04 -0.17128E-04 -0.28434E-03 16592 0.354E-02 Linear response G [H, r] |phi>, progress : Direction: 3 N E dE d eps ncg rms RMM: 1 -0.214508117852E+04 -0.21451E+04 0.12029E+03 21924 0.111E+02 RMM: 2 -0.191664598742E+04 0.22844E+03 -0.23478E+02 15402 0.239E+01 RMM: 3 -0.191995161597E+04 -0.33056E+01 -0.84650E+00 15618 0.383E+00 RMM: 4 -0.192020991175E+04 -0.25830E+00 -0.37256E-01 15946 0.742E-01 RMM: 5 -0.192022239325E+04 -0.12482E-01 -0.37860E-02 15935 0.182E-01 RMM: 6 -0.192022374658E+04 -0.13533E-02 -0.48579E-03 15960 0.599E-02 RMM: 7 -0.192022389207E+04 -0.14549E-03 -0.32237E-03 16145 0.394E-02 RMM: 8 -0.192022390107E+04 -0.89956E-05 -0.29260E-03 16205 0.357E-02 RMM: 9 -0.192022390621E+04 -0.51417E-05 -0.29425E-03 16220 0.354E-02 RMM: 10 -0.192022392044E+04 -0.14227E-04 -0.30223E-03 16528 0.353E-02 Linear response to external field (no local field effect), progress : Direction: 1 N E dE d eps ncg rms rms(c) RMM: 1 -0.709441262978E+01 -0.70944E+01 -0.21817E+01 15337 0.377E+00 RMM: 2 -0.732439455015E+01 -0.22998E+00 -0.26087E-01 15542 0.713E-01 RMM: 3 -0.732884574664E+01 -0.44512E-02 -0.86573E-03 15743 0.107E-01 RMM: 4 -0.732914493973E+01 -0.29919E-03 -0.49091E-04 15756 0.225E-02 RMM: 5 -0.732916203341E+01 -0.17094E-04 -0.55329E-05 14062 0.642E-03 RMM: 6 -0.732916396479E+01 -0.19314E-05 -0.17002E-05 13397 0.312E-03 Linear response to external field (no local field effect), progress : Direction: 2 N E dE d eps ncg rms rms(c) RMM: 1 -0.701058321453E+01 -0.70106E+01 -0.21165E+01 15383 0.382E+00 RMM: 2 -0.721144167240E+01 -0.20086E+00 -0.26376E-01 15551 0.721E-01 RMM: 3 -0.721580252353E+01 -0.43609E-02 -0.84394E-03 15739 0.107E-01 RMM: 4 -0.721608404489E+01 -0.28152E-03 -0.46329E-04 15764 0.225E-02 RMM: 5 -0.721610002063E+01 -0.15976E-04 -0.51691E-05 14011 0.637E-03 RMM: 6 -0.721610174007E+01 -0.17194E-05 -0.16548E-05 13356 0.310E-03 Linear response to external field (no local field effect), progress : Direction: 3 N E dE d eps ncg rms rms(c) RMM: 1 -0.715751346884E+01 -0.71575E+01 -0.22156E+01 15381 0.384E+00 RMM: 2 -0.742076937729E+01 -0.26326E+00 -0.26525E-01 15610 0.726E-01 RMM: 3 -0.742530649639E+01 -0.45371E-02 -0.88398E-03 15769 0.109E-01 RMM: 4 -0.742561423588E+01 -0.30774E-03 -0.50246E-04 15747 0.230E-02 RMM: 5 -0.742563162404E+01 -0.17388E-04 -0.55645E-05 14037 0.651E-03 RMM: 6 -0.742563354327E+01 -0.19192E-05 -0.17426E-05 13436 0.314E-03 Linear response to external field, progress : Direction: 1 N E dE d eps ncg rms rms(c) RMM: 1 -0.709441262978E+01 -0.70944E+01 -0.21817E+01 15337 0.377E+00 RMM: 2 -0.732439455015E+01 -0.22998E+00 -0.26087E-01 15542 0.713E-01 0.519E+00 RMM: 3 -0.648409487550E+01 0.84030E+00 -0.13433E+00 15743 0.157E+00 0.273E+00 RMM: 4 -0.600590672795E+01 0.47819E+00 -0.23146E-01 15789 0.696E-01 0.127E+00 RMM: 5 -0.558146280994E+01 0.42444E+00 -0.12002E-01 15721 0.470E-01 0.379E-01 RMM: 6 -0.551527802984E+01 0.66185E-01 -0.10378E-02 15805 0.129E-01 0.218E-01 RMM: 7 -0.547746199532E+01 0.37816E-01 -0.43676E-03 15480 0.903E-02 0.635E-02 RMM: 8 -0.546524537103E+01 0.12217E-01 -0.11963E-03 15839 0.308E-02 0.369E-02 RMM: 9 -0.546388427360E+01 0.13611E-02 -0.61437E-04 15817 0.187E-02 0.151E-02 RMM: 10 -0.546434363557E+01 -0.45936E-03 -0.29403E-04 15937 0.786E-03 0.828E-03 RMM: 11 -0.546528977739E+01 -0.94614E-03 -0.21358E-04 15961 0.457E-03 0.387E-03 RMM: 12 -0.546591334817E+01 -0.62357E-03 -0.16130E-04 15684 0.314E-03 0.171E-03 RMM: 13 -0.546619971609E+01 -0.28637E-03 -0.13488E-04 15304 0.261E-03 0.840E-04 RMM: 14 -0.546625405348E+01 -0.54337E-04 -0.83190E-05 15387 0.245E-03 0.414E-04 RMM: 15 -0.546623648170E+01 0.17572E-04 -0.13943E-04 15821 0.240E-03 0.164E-04 RMM: 16 -0.546621987641E+01 0.16605E-04 -0.17824E-04 15858 0.237E-03 0.931E-05 RMM: 17 -0.546621220522E+01 0.76712E-05 -0.18626E-04 15906 0.236E-03 0.402E-05 RMM: 18 -0.546621060712E+01 0.15981E-05 -0.18963E-04 15966 0.236E-03 0.220E-05 RMM: 19 -0.546621039620E+01 0.21092E-06 -0.19666E-04 16076 0.236E-03 0.102E-05 RMM: 20 -0.546621152898E+01 -0.11328E-05 -0.19041E-04 16094 0.236E-03 0.519E-06 Linear response to external field, progress : Direction: 2 N E dE d eps ncg rms rms(c) RMM: 1 -0.701058321453E+01 -0.70106E+01 -0.21165E+01 15383 0.382E+00 RMM: 2 -0.721144167240E+01 -0.20086E+00 -0.26376E-01 15551 0.721E-01 0.550E+00 RMM: 3 -0.625316661516E+01 0.95828E+00 -0.18869E+00 15709 0.182E+00 0.288E+00 RMM: 4 -0.589154307209E+01 0.36162E+00 -0.28010E-01 15701 0.767E-01 0.150E+00 RMM: 5 -0.542943926197E+01 0.46210E+00 -0.15119E-01 15713 0.534E-01 0.421E-01 RMM: 6 -0.533283823827E+01 0.96601E-01 -0.12986E-02 15824 0.149E-01 0.233E-01 RMM: 7 -0.529171729958E+01 0.41121E-01 -0.29876E-03 15508 0.872E-02 0.600E-02 RMM: 8 -0.527837819381E+01 0.13339E-01 -0.71658E-04 15814 0.261E-02 0.351E-02 RMM: 9 -0.527460041356E+01 0.37778E-02 -0.47009E-04 15866 0.170E-02 0.120E-02 RMM: 10 -0.527422575851E+01 0.37466E-03 -0.33624E-04 16045 0.676E-03 0.649E-03 RMM: 11 -0.527464206684E+01 -0.41631E-03 -0.36446E-04 15769 0.372E-03 0.346E-03 RMM: 12 -0.527509026380E+01 -0.44820E-03 -0.41724E-04 15699 0.316E-03 0.137E-03 RMM: 13 -0.527526088528E+01 -0.17062E-03 -0.46981E-04 15128 0.260E-03 0.762E-04 RMM: 14 -0.527535538762E+01 -0.94502E-04 -0.42518E-04 15425 0.251E-03 0.355E-04 RMM: 15 -0.527534529628E+01 0.10091E-04 -0.42856E-04 15789 0.246E-03 0.159E-04 RMM: 16 -0.527532591616E+01 0.19380E-04 -0.40783E-04 15828 0.244E-03 0.792E-05 RMM: 17 -0.527532843684E+01 -0.25207E-05 -0.51874E-04 15880 0.243E-03 0.373E-05 RMM: 18 -0.527531528316E+01 0.13154E-04 -0.41177E-04 15999 0.243E-03 0.195E-05 RMM: 19 -0.527531358087E+01 0.17023E-05 -0.41056E-04 16127 0.242E-03 0.923E-06 Linear response to external field, progress : Direction: 3 N E dE d eps ncg rms rms(c) RMM: 1 -0.715751346884E+01 -0.71575E+01 -0.22156E+01 15381 0.384E+00 RMM: 2 -0.742076937729E+01 -0.26326E+00 -0.26525E-01 15610 0.726E-01 0.550E+00 RMM: 3 -0.649120757202E+01 0.92956E+00 -0.17597E+00 15753 0.176E+00 0.284E+00 RMM: 4 -0.608627496226E+01 0.40493E+00 -0.25583E-01 15750 0.722E-01 0.145E+00 RMM: 5 -0.563063454337E+01 0.45564E+00 -0.14620E-01 15701 0.516E-01 0.401E-01 RMM: 6 -0.554116186349E+01 0.89473E-01 -0.18094E-02 15824 0.145E-01 0.223E-01 RMM: 7 -0.550298410231E+01 0.38178E-01 -0.45816E-03 15508 0.864E-02 0.639E-02 RMM: 8 -0.548808309631E+01 0.14901E-01 -0.17736E-03 15841 0.303E-02 0.399E-02 RMM: 9 -0.548447603948E+01 0.36071E-02 -0.84652E-04 15836 0.206E-02 0.168E-02 RMM: 10 -0.548449766755E+01 -0.21628E-04 -0.45255E-04 15977 0.938E-03 0.989E-03 RMM: 11 -0.548552845620E+01 -0.10308E-02 -0.19476E-04 16077 0.504E-03 0.505E-03 RMM: 12 -0.548652619827E+01 -0.99774E-03 -0.84841E-05 15646 0.374E-03 0.186E-03 RMM: 13 -0.548681790548E+01 -0.29171E-03 -0.32750E-04 15676 0.272E-03 0.960E-04 RMM: 14 -0.548686650507E+01 -0.48600E-04 -0.11433E-04 14961 0.247E-03 0.486E-04 RMM: 15 -0.548683807917E+01 0.28426E-04 -0.14085E-04 15699 0.244E-03 0.215E-04 RMM: 16 -0.548682741957E+01 0.10660E-04 -0.20125E-04 15744 0.241E-03 0.118E-04 RMM: 17 -0.548680472546E+01 0.22694E-04 -0.11969E-04 15857 0.240E-03 0.518E-05 RMM: 18 -0.548679971613E+01 0.50093E-05 -0.90017E-05 15959 0.239E-03 0.270E-05 Linear response DOF= 336 Linear response progress: Degree of freedom: 1/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.119044497220E+00 -0.11904E+00 0.81144E-02 21297 0.411E-01 RMM: 2 -0.114436682557E+00 0.46078E-02 -0.60838E-03 15110 0.881E-02 0.235E-01 RMM: 3 -0.110372820476E+00 0.40639E-02 -0.20436E-03 15359 0.470E-02 0.116E-01 RMM: 4 -0.107473933767E+00 0.28989E-02 -0.16468E-03 15574 0.389E-02 0.208E-02 RMM: 5 -0.107690050555E+00 -0.21612E-03 -0.34704E-05 15668 0.795E-03 0.894E-03 RMM: 6 -0.107682424288E+00 0.76263E-05 -0.28174E-06 15866 0.212E-03 0.246E-03 Linear response progress: Degree of freedom: 2/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.117419583649E+00 -0.11742E+00 0.71619E-02 21622 0.398E-01 RMM: 2 -0.113854396385E+00 0.35652E-02 -0.53852E-03 15344 0.833E-02 0.228E-01 RMM: 3 -0.109702589645E+00 0.41518E-02 -0.21484E-03 15550 0.478E-02 0.115E-01 RMM: 4 -0.106853597171E+00 0.28490E-02 -0.16194E-03 15721 0.388E-02 0.238E-02 RMM: 5 -0.107051845653E+00 -0.19825E-03 -0.33361E-05 15736 0.788E-03 0.994E-03 RMM: 6 -0.107059435061E+00 -0.75894E-05 -0.33503E-06 15854 0.239E-03 0.277E-03 Linear response progress: Degree of freedom: 3/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.116016625959E+00 -0.11602E+00 0.10425E-01 21044 0.413E-01 RMM: 2 -0.113364273496E+00 0.26524E-02 -0.51261E-03 15145 0.832E-02 0.233E-01 RMM: 3 -0.109311831711E+00 0.40524E-02 -0.20375E-03 15429 0.468E-02 0.116E-01 RMM: 4 -0.106432216282E+00 0.28796E-02 -0.16965E-03 15664 0.394E-02 0.217E-02 RMM: 5 -0.106685044833E+00 -0.25283E-03 -0.35847E-05 15665 0.804E-03 0.917E-03 RMM: 6 -0.106673974936E+00 0.11070E-04 -0.27297E-06 15852 0.217E-03 0.244E-03 RMM: 7 -0.106680958737E+00 -0.69838E-05 -0.42713E-07 15842 0.796E-04 0.132E-03 Linear response progress: Degree of freedom: 4/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.118780471892E+00 -0.11878E+00 0.58673E-02 21377 0.394E-01 RMM: 2 -0.114290991994E+00 0.44895E-02 -0.48313E-03 15096 0.835E-02 0.228E-01 RMM: 3 -0.109949418969E+00 0.43416E-02 -0.20536E-03 15284 0.485E-02 0.119E-01 RMM: 4 -0.107122454510E+00 0.28270E-02 -0.15026E-03 15654 0.387E-02 0.281E-02 RMM: 5 -0.107339393822E+00 -0.21694E-03 -0.47903E-05 15654 0.898E-03 0.810E-03 RMM: 6 -0.107284072880E+00 0.55321E-04 -0.32036E-06 15859 0.214E-03 0.306E-03 RMM: 7 -0.107323770696E+00 -0.39698E-04 -0.96116E-07 15880 0.124E-03 0.100E-03 RMM: 8 -0.107326540348E+00 -0.27697E-05 -0.29047E-07 15945 0.595E-04 0.652E-04 Linear response progress: Degree of freedom: 5/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.114737910937E+00 -0.11474E+00 0.10421E-01 19833 0.415E-01 RMM: 2 -0.113148626421E+00 0.15893E-02 -0.43955E-03 14992 0.794E-02 0.228E-01 RMM: 3 -0.109106365225E+00 0.40423E-02 -0.19853E-03 15310 0.460E-02 0.111E-01 RMM: 4 -0.106334595947E+00 0.27718E-02 -0.15456E-03 15595 0.380E-02 0.209E-02 RMM: 5 -0.106560493922E+00 -0.22590E-03 -0.37993E-05 15621 0.801E-03 0.888E-03 RMM: 6 -0.106558304510E+00 0.21894E-05 -0.26019E-06 15851 0.207E-03 0.302E-03 Linear response progress: Degree of freedom: 6/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.114119988138E+00 -0.11412E+00 0.12150E-01 20129 0.416E-01 RMM: 2 -0.112736495547E+00 0.13835E-02 -0.42175E-03 14955 0.791E-02 0.232E-01 RMM: 3 -0.108722168540E+00 0.40143E-02 -0.19368E-03 15180 0.457E-02 0.113E-01 RMM: 4 -0.105953754022E+00 0.27684E-02 -0.14822E-03 15518 0.375E-02 0.206E-02 RMM: 5 -0.106112471212E+00 -0.15872E-03 -0.29484E-05 15626 0.733E-03 0.113E-02 RMM: 6 -0.106183105291E+00 -0.70634E-04 -0.43129E-06 15788 0.270E-03 0.296E-03 RMM: 7 -0.106151885390E+00 0.31220E-04 -0.72626E-07 15853 0.105E-03 0.121E-03 RMM: 8 -0.106171545450E+00 -0.19660E-04 -0.16593E-07 15870 0.542E-04 0.552E-04 RMM: 9 -0.106167434858E+00 0.41106E-05 -0.50627E-08 16062 0.335E-04 0.232E-04 Linear response progress: Degree of freedom: 7/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.113416565520E+00 -0.11342E+00 0.43453E-02 20633 0.371E-01 RMM: 2 -0.109901701629E+00 0.35149E-02 -0.46875E-03 14780 0.753E-02 0.198E-01 RMM: 3 -0.106622482732E+00 0.32792E-02 -0.14747E-03 15541 0.394E-02 0.101E-01 RMM: 4 -0.104275491641E+00 0.23470E-02 -0.11363E-03 15674 0.320E-02 0.205E-02 RMM: 5 -0.104434869152E+00 -0.15938E-03 -0.23450E-05 15731 0.636E-03 0.857E-03 RMM: 6 -0.104454967196E+00 -0.20098E-04 -0.23189E-06 15834 0.196E-03 0.297E-03 RMM: 7 -0.104466729346E+00 -0.11762E-04 -0.44434E-07 15843 0.812E-04 0.128E-03 RMM: 8 -0.104488921561E+00 -0.22192E-04 -0.25611E-07 15730 0.545E-04 0.467E-04 RMM: 9 -0.104481671583E+00 0.72500E-05 -0.13075E-07 15957 0.301E-04 0.278E-04 Linear response progress: Degree of freedom: 8/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.118766929969E+00 -0.11877E+00 0.89589E-02 21683 0.419E-01 RMM: 2 -0.112755610003E+00 0.60113E-02 -0.64779E-03 14816 0.935E-02 0.227E-01 RMM: 3 -0.109245733641E+00 0.35099E-02 -0.17723E-03 15475 0.441E-02 0.114E-01 RMM: 4 -0.106652848170E+00 0.25929E-02 -0.12676E-03 15558 0.345E-02 0.205E-02 RMM: 5 -0.106718173074E+00 -0.65325E-04 -0.21186E-05 15719 0.629E-03 0.103E-02 RMM: 6 -0.106755760568E+00 -0.37587E-04 -0.31458E-06 15826 0.229E-03 0.298E-03 RMM: 7 -0.106762420971E+00 -0.66604E-05 -0.43083E-07 15878 0.818E-04 0.107E-03 Linear response progress: Degree of freedom: 9/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.120890209142E+00 -0.12089E+00 0.72942E-02 22307 0.423E-01 RMM: 2 -0.113580545966E+00 0.73097E-02 -0.80508E-03 15017 0.103E-01 0.234E-01 RMM: 3 -0.109656836503E+00 0.39237E-02 -0.19469E-03 15317 0.464E-02 0.116E-01 RMM: 4 -0.106871374371E+00 0.27855E-02 -0.14782E-03 15568 0.370E-02 0.224E-02 RMM: 5 -0.107056768627E+00 -0.18539E-03 -0.37035E-05 15632 0.800E-03 0.900E-03 RMM: 6 -0.107052899049E+00 0.38696E-05 -0.26605E-06 15847 0.205E-03 0.283E-03 Linear response progress: Degree of freedom: 10/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.116183256287E+00 -0.11618E+00 0.90478E-02 20830 0.414E-01 RMM: 2 -0.112859181601E+00 0.33241E-02 -0.43614E-03 14929 0.837E-02 0.229E-01 RMM: 3 -0.108898061690E+00 0.39611E-02 -0.17990E-03 15304 0.451E-02 0.114E-01 RMM: 4 -0.106164511611E+00 0.27336E-02 -0.13311E-03 15567 0.367E-02 0.209E-02 RMM: 5 -0.106396530271E+00 -0.23202E-03 -0.30439E-05 15655 0.750E-03 0.667E-03 RMM: 6 -0.106369980351E+00 0.26550E-04 -0.17440E-06 15864 0.163E-03 0.233E-03 RMM: 7 -0.106393223691E+00 -0.23243E-04 -0.37469E-07 15862 0.762E-04 0.810E-04 RMM: 8 -0.106393812789E+00 -0.58910E-06 -0.12467E-07 15865 0.349E-04 0.386E-04 Linear response progress: Degree of freedom: 11/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.115127937271E+00 -0.11513E+00 0.13820E-01 20288 0.426E-01 RMM: 2 -0.113876998422E+00 0.12509E-02 -0.41359E-03 14898 0.806E-02 0.244E-01 RMM: 3 -0.109508228057E+00 0.43688E-02 -0.20683E-03 15178 0.481E-02 0.117E-01 RMM: 4 -0.106604021256E+00 0.29042E-02 -0.15245E-03 15662 0.388E-02 0.202E-02 RMM: 5 -0.106849593903E+00 -0.24557E-03 -0.32517E-05 15662 0.775E-03 0.720E-03 RMM: 6 -0.106801488446E+00 0.48105E-04 -0.16543E-06 15855 0.162E-03 0.199E-03 RMM: 7 -0.106813432082E+00 -0.11944E-04 -0.31376E-07 15847 0.660E-04 0.776E-04 RMM: 8 -0.106813613262E+00 -0.18118E-06 -0.10503E-07 15855 0.313E-04 0.350E-04 Linear response progress: Degree of freedom: 12/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.118290394435E+00 -0.11829E+00 0.56349E-02 21354 0.404E-01 RMM: 2 -0.113796168909E+00 0.44942E-02 -0.44142E-03 15020 0.846E-02 0.220E-01 RMM: 3 -0.109731775139E+00 0.40644E-02 -0.18454E-03 15332 0.468E-02 0.113E-01 RMM: 4 -0.107048674258E+00 0.26831E-02 -0.13196E-03 15728 0.371E-02 0.268E-02 RMM: 5 -0.107205117185E+00 -0.15644E-03 -0.35094E-05 15660 0.801E-03 0.816E-03 RMM: 6 -0.107176113936E+00 0.29003E-04 -0.24157E-06 15870 0.197E-03 0.278E-03 RMM: 7 -0.107210782269E+00 -0.34668E-04 -0.83021E-07 15870 0.108E-03 0.966E-04 RMM: 8 -0.107212260690E+00 -0.14784E-05 -0.18634E-07 15909 0.471E-04 0.575E-04 Linear response progress: Degree of freedom: 13/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.119146094269E+00 -0.11915E+00 0.58778E-02 21223 0.396E-01 RMM: 2 -0.113960035284E+00 0.51861E-02 -0.61509E-03 15005 0.872E-02 0.225E-01 RMM: 3 -0.109929843317E+00 0.40302E-02 -0.19339E-03 15321 0.455E-02 0.112E-01 RMM: 4 -0.107124759551E+00 0.28051E-02 -0.14987E-03 15577 0.372E-02 0.222E-02 RMM: 5 -0.107318448419E+00 -0.19369E-03 -0.32716E-05 15586 0.768E-03 0.894E-03 RMM: 6 -0.107323212540E+00 -0.47641E-05 -0.26448E-06 15844 0.211E-03 0.254E-03 Linear response progress: Degree of freedom: 14/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.117049732970E+00 -0.11705E+00 0.13166E-01 20483 0.413E-01 RMM: 2 -0.114104235844E+00 0.29455E-02 -0.47831E-03 14984 0.810E-02 0.249E-01 RMM: 3 -0.109635006627E+00 0.44692E-02 -0.22641E-03 15063 0.484E-02 0.120E-01 RMM: 4 -0.106618779300E+00 0.30162E-02 -0.17443E-03 15493 0.393E-02 0.197E-02 RMM: 5 -0.106903331238E+00 -0.28455E-03 -0.34266E-05 15543 0.786E-03 0.805E-03 RMM: 6 -0.106851103483E+00 0.52228E-04 -0.21728E-06 15848 0.189E-03 0.162E-03 RMM: 7 -0.106877596387E+00 -0.26493E-04 -0.36912E-07 15812 0.696E-04 0.720E-04 RMM: 8 -0.106879054778E+00 -0.14584E-05 -0.11978E-07 15826 0.378E-04 0.314E-04 Linear response progress: Degree of freedom: 15/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.118836384967E+00 -0.11884E+00 0.61501E-02 21118 0.383E-01 RMM: 2 -0.115041091165E+00 0.37953E-02 -0.52055E-03 15091 0.810E-02 0.228E-01 RMM: 3 -0.110720560781E+00 0.43205E-02 -0.20350E-03 15196 0.473E-02 0.116E-01 RMM: 4 -0.107844873544E+00 0.28757E-02 -0.15484E-03 15550 0.382E-02 0.257E-02 RMM: 5 -0.108053302281E+00 -0.20843E-03 -0.36854E-05 15646 0.814E-03 0.893E-03 RMM: 6 -0.108041840907E+00 0.11461E-04 -0.27948E-06 15862 0.213E-03 0.273E-03 RMM: 7 -0.108061550968E+00 -0.19710E-04 -0.66747E-07 15881 0.100E-03 0.911E-04 RMM: 8 -0.108070398164E+00 -0.88472E-05 -0.17832E-07 15888 0.508E-04 0.502E-04 Linear response progress: Degree of freedom: 16/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.116681965720E+00 -0.11668E+00 0.90479E-02 20863 0.404E-01 RMM: 2 -0.114241259467E+00 0.24407E-02 -0.52796E-03 15131 0.820E-02 0.232E-01 RMM: 3 -0.109986595476E+00 0.42547E-02 -0.21194E-03 15407 0.473E-02 0.115E-01 RMM: 4 -0.107105635365E+00 0.28810E-02 -0.16346E-03 15703 0.388E-02 0.235E-02 RMM: 5 -0.107351247575E+00 -0.24561E-03 -0.45459E-05 15644 0.878E-03 0.901E-03 RMM: 6 -0.107325995520E+00 0.25252E-04 -0.30330E-06 15819 0.220E-03 0.328E-03 RMM: 7 -0.107314283302E+00 0.11712E-04 -0.67289E-07 15865 0.976E-04 0.159E-03 RMM: 8 -0.107334556598E+00 -0.20273E-04 -0.21206E-07 15849 0.628E-04 0.587E-04 RMM: 9 -0.107335806252E+00 -0.12497E-05 -0.77504E-08 16006 0.354E-04 0.358E-04 Linear response progress: Degree of freedom: 17/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.118231893195E+00 -0.11823E+00 0.86139E-02 21354 0.410E-01 RMM: 2 -0.114387875417E+00 0.38440E-02 -0.53367E-03 15233 0.854E-02 0.240E-01 RMM: 3 -0.109937659603E+00 0.44502E-02 -0.23191E-03 15459 0.496E-02 0.117E-01 RMM: 4 -0.106968213686E+00 0.29694E-02 -0.16680E-03 15625 0.394E-02 0.222E-02 RMM: 5 -0.107178115899E+00 -0.20990E-03 -0.31849E-05 15652 0.771E-03 0.925E-03 RMM: 6 -0.107181853646E+00 -0.37377E-05 -0.20884E-06 15817 0.195E-03 0.233E-03 Linear response progress: Degree of freedom: 18/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.118648719519E+00 -0.11865E+00 0.87866E-02 20931 0.409E-01 RMM: 2 -0.115020933779E+00 0.36278E-02 -0.59166E-03 15177 0.873E-02 0.236E-01 RMM: 3 -0.110756113468E+00 0.42648E-02 -0.20756E-03 15246 0.474E-02 0.117E-01 RMM: 4 -0.107771738842E+00 0.29844E-02 -0.16889E-03 15597 0.395E-02 0.219E-02 RMM: 5 -0.108022565241E+00 -0.25083E-03 -0.39137E-05 15635 0.833E-03 0.863E-03 RMM: 6 -0.107997334930E+00 0.25230E-04 -0.25705E-06 15832 0.207E-03 0.263E-03 RMM: 7 -0.107996354208E+00 0.98072E-06 -0.30407E-07 15861 0.711E-04 0.135E-03 Linear response progress: Degree of freedom: 19/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.333786036547E-01 -0.33379E-01 -0.73058E-02 26383 0.328E-01 RMM: 2 -0.171955548740E-01 0.16183E-01 -0.39705E-03 15239 0.999E-02 0.183E-01 RMM: 3 -0.172421150342E-01 -0.46560E-04 -0.48757E-04 15706 0.297E-02 0.110E-01 RMM: 4 -0.172058042364E-01 0.36311E-04 -0.55776E-04 15826 0.313E-02 0.231E-02 RMM: 5 -0.172651070370E-01 -0.59303E-04 -0.62295E-05 15774 0.896E-03 0.925E-03 RMM: 6 -0.172583991072E-01 0.67079E-05 -0.71338E-06 15760 0.370E-03 0.461E-03 Linear response progress: Degree of freedom: 20/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.346408527176E-01 -0.34641E-01 -0.61545E-02 26887 0.351E-01 RMM: 2 -0.180245072974E-01 0.16616E-01 -0.43711E-03 15266 0.104E-01 0.187E-01 RMM: 3 -0.180164952711E-01 0.80120E-05 -0.48698E-04 15753 0.283E-02 0.112E-01 RMM: 4 -0.179298833719E-01 0.86612E-04 -0.58031E-04 15858 0.311E-02 0.196E-02 RMM: 5 -0.179492569054E-01 -0.19374E-04 -0.52686E-05 15824 0.829E-03 0.896E-03 RMM: 6 -0.179380640622E-01 0.11193E-04 -0.11073E-05 15837 0.378E-03 0.458E-03 RMM: 7 -0.179260628484E-01 0.12001E-04 -0.53636E-06 15846 0.194E-03 0.227E-03 RMM: 8 -0.179167004699E-01 0.93624E-05 -0.37943E-06 15915 0.124E-03 0.125E-03 Linear response progress: Degree of freedom: 21/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.330928082444E-01 -0.33093E-01 -0.64056E-02 26554 0.339E-01 RMM: 2 -0.167819224235E-01 0.16311E-01 -0.40207E-03 15211 0.100E-01 0.188E-01 RMM: 3 -0.169541783933E-01 -0.17226E-03 -0.48898E-04 15753 0.294E-02 0.113E-01 RMM: 4 -0.171080730913E-01 -0.15389E-03 -0.52136E-04 15863 0.308E-02 0.193E-02 RMM: 5 -0.171346307957E-01 -0.26558E-04 -0.38389E-05 15800 0.778E-03 0.876E-03 RMM: 6 -0.171335925310E-01 0.10383E-05 -0.62376E-06 15821 0.339E-03 0.432E-03 Linear response progress: Degree of freedom: 22/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.397270137562E-01 -0.39727E-01 -0.54684E-02 26880 0.422E-01 RMM: 2 -0.190399908857E-01 0.20687E-01 -0.59308E-03 15514 0.128E-01 0.228E-01 RMM: 3 -0.191636288745E-01 -0.12364E-03 -0.66265E-04 15726 0.374E-02 0.135E-01 RMM: 4 -0.192327588228E-01 -0.69130E-04 -0.69529E-04 15780 0.372E-02 0.221E-02 RMM: 5 -0.192889577301E-01 -0.56199E-04 -0.59529E-05 15790 0.924E-03 0.113E-02 RMM: 6 -0.193011544356E-01 -0.12197E-04 -0.86395E-06 15742 0.464E-03 0.558E-03 RMM: 7 -0.193114133050E-01 -0.10259E-04 -0.23473E-06 15599 0.242E-03 0.237E-03 RMM: 8 -0.193050636614E-01 0.63496E-05 -0.83611E-07 15867 0.120E-03 0.113E-03 Linear response progress: Degree of freedom: 23/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.411745339312E-01 -0.41175E-01 -0.48600E-02 26943 0.428E-01 RMM: 2 -0.204996083910E-01 0.20675E-01 -0.58634E-03 15394 0.129E-01 0.238E-01 RMM: 3 -0.204824958373E-01 0.17113E-04 -0.72919E-04 15715 0.378E-02 0.141E-01 RMM: 4 -0.203441772904E-01 0.13832E-03 -0.81968E-04 15838 0.390E-02 0.242E-02 RMM: 5 -0.203891433006E-01 -0.44966E-04 -0.80041E-05 15828 0.103E-02 0.115E-02 RMM: 6 -0.203872952140E-01 0.18481E-05 -0.10117E-05 15818 0.480E-03 0.586E-03 Linear response progress: Degree of freedom: 24/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.411170615752E-01 -0.41117E-01 -0.43211E-02 27027 0.432E-01 RMM: 2 -0.207435867417E-01 0.20373E-01 -0.65009E-03 15506 0.129E-01 0.234E-01 RMM: 3 -0.205928414149E-01 0.15075E-03 -0.66832E-04 15754 0.369E-02 0.139E-01 RMM: 4 -0.203944233110E-01 0.19842E-03 -0.73939E-04 15807 0.386E-02 0.242E-02 RMM: 5 -0.204386586343E-01 -0.44235E-04 -0.49157E-05 15832 0.104E-02 0.113E-02 RMM: 6 -0.204348487067E-01 0.38099E-05 -0.26548E-06 15850 0.465E-03 0.572E-03 Linear response progress: Degree of freedom: 25/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.417809458060E-01 -0.41781E-01 -0.28692E-02 26591 0.454E-01 RMM: 2 -0.200660222363E-01 0.21715E-01 -0.73020E-03 15661 0.139E-01 0.236E-01 RMM: 3 -0.202090981837E-01 -0.14308E-03 -0.76386E-04 15613 0.394E-02 0.138E-01 RMM: 4 -0.203091133488E-01 -0.10002E-03 -0.82211E-04 15720 0.407E-02 0.221E-02 RMM: 5 -0.204104636584E-01 -0.10135E-03 -0.80656E-05 15835 0.108E-02 0.122E-02 RMM: 6 -0.204269296555E-01 -0.16466E-04 -0.13476E-05 15710 0.590E-03 0.650E-03 RMM: 7 -0.204509201896E-01 -0.23991E-04 -0.50650E-06 15588 0.292E-03 0.282E-03 RMM: 8 -0.204426544082E-01 0.82658E-05 -0.13676E-06 15862 0.174E-03 0.146E-03 Linear response progress: Degree of freedom: 26/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.412259839288E-01 -0.41226E-01 -0.27486E-02 27036 0.456E-01 RMM: 2 -0.203293766362E-01 0.20897E-01 -0.67200E-03 15667 0.136E-01 0.230E-01 RMM: 3 -0.203465107251E-01 -0.17134E-04 -0.70703E-04 15763 0.372E-02 0.136E-01 RMM: 4 -0.203464722492E-01 0.38476E-07 -0.96568E-04 15852 0.417E-02 0.221E-02 RMM: 5 -0.204259832696E-01 -0.79511E-04 -0.69512E-05 15855 0.111E-02 0.108E-02 RMM: 6 -0.204407113815E-01 -0.14728E-04 -0.12705E-05 15795 0.551E-03 0.515E-03 RMM: 7 -0.204449586274E-01 -0.42472E-05 -0.20277E-06 15845 0.227E-03 0.287E-03 Linear response progress: Degree of freedom: 27/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.531519456336E-01 -0.53152E-01 -0.92942E-02 26711 0.488E-01 RMM: 2 -0.219743429179E-01 0.31178E-01 -0.87562E-03 15423 0.150E-01 0.276E-01 RMM: 3 -0.217456108215E-01 0.22873E-03 -0.86826E-04 15715 0.430E-02 0.159E-01 RMM: 4 -0.215138493032E-01 0.23176E-03 -0.97449E-04 15834 0.439E-02 0.246E-02 RMM: 5 -0.215735874452E-01 -0.59738E-04 -0.84150E-05 15856 0.118E-02 0.136E-02 RMM: 6 -0.215856943776E-01 -0.12107E-04 -0.17784E-05 15783 0.674E-03 0.710E-03 RMM: 7 -0.215979349515E-01 -0.12241E-04 -0.58034E-06 15825 0.361E-03 0.326E-03 RMM: 8 -0.215790756144E-01 0.18859E-04 -0.33706E-06 15881 0.253E-03 0.249E-03 RMM: 9 -0.215791094303E-01 -0.33816E-07 -0.67899E-07 15826 0.122E-03 0.818E-04 Linear response progress: Degree of freedom: 28/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.448560140251E-01 -0.44856E-01 -0.30619E-02 26891 0.452E-01 RMM: 2 -0.228110571534E-01 0.22045E-01 -0.66316E-03 15281 0.132E-01 0.285E-01 RMM: 3 -0.225225100737E-01 0.28855E-03 -0.10970E-03 15773 0.417E-02 0.165E-01 RMM: 4 -0.223583098850E-01 0.16420E-03 -0.53383E-04 15930 0.299E-02 0.637E-02 RMM: 5 -0.222394598811E-01 0.11885E-03 -0.14565E-04 15886 0.155E-02 0.147E-02 RMM: 6 -0.222613923361E-01 -0.21932E-04 -0.21069E-05 15876 0.588E-03 0.642E-03 RMM: 7 -0.222545958350E-01 0.67965E-05 -0.65411E-06 15881 0.354E-03 0.317E-03 Linear response progress: Degree of freedom: 29/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.352297257733E-01 -0.35230E-01 0.11113E-02 26767 0.426E-01 RMM: 2 -0.198976247261E-01 0.15332E-01 -0.59157E-03 15484 0.125E-01 0.234E-01 RMM: 3 -0.200587760591E-01 -0.16115E-03 -0.84619E-04 15586 0.392E-02 0.136E-01 RMM: 4 -0.201759489653E-01 -0.11717E-03 -0.47008E-04 15833 0.294E-02 0.486E-02 RMM: 5 -0.201874337726E-01 -0.11485E-04 -0.12316E-04 15775 0.139E-02 0.131E-02 RMM: 6 -0.202245770017E-01 -0.37143E-04 -0.18004E-05 15811 0.528E-03 0.557E-03 RMM: 7 -0.202301952458E-01 -0.56182E-05 -0.42449E-06 15792 0.310E-03 0.259E-03 Linear response progress: Degree of freedom: 30/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.322881918936E-01 -0.32288E-01 -0.11133E-02 26882 0.386E-01 RMM: 2 -0.184924104001E-01 0.13796E-01 -0.46605E-03 15399 0.114E-01 0.222E-01 RMM: 3 -0.187439819824E-01 -0.25157E-03 -0.79248E-04 15651 0.386E-02 0.128E-01 RMM: 4 -0.189678928394E-01 -0.22391E-03 -0.33673E-04 15857 0.253E-02 0.537E-02 RMM: 5 -0.190405997861E-01 -0.72707E-04 -0.10184E-04 15739 0.146E-02 0.124E-02 RMM: 6 -0.190798253972E-01 -0.39226E-04 -0.88396E-06 15848 0.472E-03 0.599E-03 RMM: 7 -0.190913634265E-01 -0.11538E-04 -0.29953E-06 15745 0.328E-03 0.265E-03 RMM: 8 -0.190892988733E-01 0.20646E-05 0.49266E-09 15911 0.112E-03 0.134E-03 Linear response progress: Degree of freedom: 31/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.434449336660E-01 -0.43445E-01 -0.50057E-02 27018 0.441E-01 RMM: 2 -0.205023409318E-01 0.22943E-01 -0.68131E-03 15278 0.133E-01 0.241E-01 RMM: 3 -0.203421917601E-01 0.16015E-03 -0.73581E-04 15705 0.357E-02 0.142E-01 RMM: 4 -0.201764246435E-01 0.16577E-03 -0.82226E-04 15802 0.379E-02 0.229E-02 RMM: 5 -0.202321672678E-01 -0.55743E-04 -0.83409E-05 15792 0.978E-03 0.120E-02 RMM: 6 -0.202449564805E-01 -0.12789E-04 -0.12533E-05 15824 0.425E-03 0.603E-03 RMM: 7 -0.202498236275E-01 -0.48671E-05 -0.55472E-06 15683 0.308E-03 0.291E-03 Linear response progress: Degree of freedom: 32/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.496016579595E-01 -0.49602E-01 -0.95318E-02 26984 0.454E-01 RMM: 2 -0.212598945373E-01 0.28342E-01 -0.77696E-03 15377 0.139E-01 0.255E-01 RMM: 3 -0.209849771447E-01 0.27492E-03 -0.74741E-04 15709 0.383E-02 0.148E-01 RMM: 4 -0.207002912243E-01 0.28469E-03 -0.81257E-04 15835 0.393E-02 0.241E-02 RMM: 5 -0.207392200842E-01 -0.38929E-04 -0.67153E-05 15838 0.994E-03 0.122E-02 RMM: 6 -0.207443673551E-01 -0.51473E-05 -0.67374E-06 15835 0.440E-03 0.619E-03 Linear response progress: Degree of freedom: 33/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.262484338891E-01 -0.26248E-01 -0.28590E-02 26104 0.307E-01 RMM: 2 -0.158402538722E-01 0.10408E-01 -0.31234E-03 15509 0.897E-02 0.153E-01 RMM: 3 -0.163785318833E-01 -0.53828E-03 -0.36112E-04 15709 0.272E-02 0.935E-02 RMM: 4 -0.169329328192E-01 -0.55440E-03 -0.48215E-04 15750 0.307E-02 0.202E-02 RMM: 5 -0.170353179253E-01 -0.10239E-03 -0.40824E-05 15746 0.787E-03 0.832E-03 RMM: 6 -0.170587788422E-01 -0.23461E-04 -0.53324E-06 15757 0.319E-03 0.427E-03 RMM: 7 -0.170667463860E-01 -0.79675E-05 -0.18332E-06 15624 0.163E-03 0.196E-03 Linear response progress: Degree of freedom: 34/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.331600112752E-01 -0.33160E-01 -0.29684E-02 26657 0.308E-01 RMM: 2 -0.197622689559E-01 0.13398E-01 -0.40775E-03 15213 0.953E-02 0.196E-01 RMM: 3 -0.196947655517E-01 0.67503E-04 -0.51243E-04 15662 0.278E-02 0.114E-01 RMM: 4 -0.195161910199E-01 0.17857E-03 -0.45219E-04 15814 0.268E-02 0.256E-02 RMM: 5 -0.195094920487E-01 0.66990E-05 -0.39466E-05 15818 0.709E-03 0.121E-02 RMM: 6 -0.195035156188E-01 0.59764E-05 -0.10635E-05 15878 0.377E-03 0.541E-03 Linear response progress: Degree of freedom: 35/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.287630514856E-01 -0.28763E-01 -0.16348E-02 26737 0.348E-01 RMM: 2 -0.167111479423E-01 0.12052E-01 -0.41326E-03 14949 0.103E-01 0.193E-01 RMM: 3 -0.169061864633E-01 -0.19504E-03 -0.65616E-04 15643 0.336E-02 0.112E-01 RMM: 4 -0.170551577130E-01 -0.14897E-03 -0.26756E-04 15849 0.213E-02 0.453E-02 RMM: 5 -0.170740209011E-01 -0.18863E-04 -0.95207E-05 15835 0.123E-02 0.103E-02 RMM: 6 -0.170820978524E-01 -0.80770E-05 -0.15991E-05 15845 0.355E-03 0.510E-03 Linear response progress: Degree of freedom: 36/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.239875504049E-01 -0.23988E-01 0.26827E-02 26186 0.311E-01 RMM: 2 -0.178047586648E-01 0.61828E-02 -0.34878E-03 14858 0.897E-02 0.192E-01 RMM: 3 -0.178795232694E-01 -0.74765E-04 -0.70070E-04 15686 0.320E-02 0.111E-01 RMM: 4 -0.179644035391E-01 -0.84880E-04 -0.27640E-04 15840 0.197E-02 0.529E-02 RMM: 5 -0.179551299756E-01 0.92736E-05 -0.12809E-04 15882 0.137E-02 0.116E-02 RMM: 6 -0.179639338917E-01 -0.88039E-05 -0.15528E-05 15855 0.383E-03 0.544E-03 Linear response progress: Degree of freedom: 37/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.490232715717E-01 -0.49023E-01 -0.85269E-02 26865 0.430E-01 RMM: 2 -0.218528116473E-01 0.27170E-01 -0.82362E-03 15216 0.138E-01 0.300E-01 RMM: 3 -0.215000870521E-01 0.35272E-03 -0.94615E-04 15541 0.429E-02 0.170E-01 RMM: 4 -0.211694087453E-01 0.33068E-03 -0.85074E-04 15825 0.389E-02 0.305E-02 RMM: 5 -0.211996178262E-01 -0.30209E-04 -0.65665E-05 15826 0.100E-02 0.125E-02 RMM: 6 -0.212142577219E-01 -0.14640E-04 -0.12056E-05 15763 0.517E-03 0.615E-03 RMM: 7 -0.212235347230E-01 -0.92770E-05 -0.48177E-06 15810 0.317E-03 0.308E-03 Linear response progress: Degree of freedom: 38/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.249107127437E-01 -0.24911E-01 0.21739E-02 26617 0.342E-01 RMM: 2 -0.161409090560E-01 0.87698E-02 -0.42052E-03 15018 0.102E-01 0.186E-01 RMM: 3 -0.165564104309E-01 -0.41550E-03 -0.47142E-04 15744 0.294E-02 0.111E-01 RMM: 4 -0.169614091133E-01 -0.40500E-03 -0.39393E-04 15749 0.290E-02 0.211E-02 RMM: 5 -0.170344077507E-01 -0.72999E-04 -0.36428E-05 15761 0.707E-03 0.107E-02 RMM: 6 -0.170706642877E-01 -0.36257E-04 -0.66327E-06 15648 0.353E-03 0.490E-03 RMM: 7 -0.170833129631E-01 -0.12649E-04 -0.29724E-06 15779 0.214E-03 0.189E-03 RMM: 8 -0.170792666787E-01 0.40463E-05 -0.12208E-06 15864 0.105E-03 0.813E-04 Linear response progress: Degree of freedom: 39/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.319015114702E-01 -0.31902E-01 0.53828E-03 27032 0.371E-01 RMM: 2 -0.190106319829E-01 0.12891E-01 -0.52257E-03 15316 0.115E-01 0.209E-01 RMM: 3 -0.189788963576E-01 0.31736E-04 -0.61113E-04 15823 0.321E-02 0.127E-01 RMM: 4 -0.189712463368E-01 0.76500E-05 -0.48932E-04 15807 0.310E-02 0.297E-02 RMM: 5 -0.189808845330E-01 -0.96382E-05 -0.34851E-05 15852 0.852E-03 0.140E-02 RMM: 6 -0.189984108823E-01 -0.17526E-04 -0.19705E-05 15763 0.552E-03 0.497E-03 RMM: 7 -0.189886965961E-01 0.97143E-05 -0.49737E-06 15855 0.230E-03 0.274E-03 Linear response progress: Degree of freedom: 40/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.470246472911E-01 -0.47025E-01 -0.75499E-02 26810 0.450E-01 RMM: 2 -0.210603639383E-01 0.25964E-01 -0.76069E-03 15317 0.135E-01 0.262E-01 RMM: 3 -0.206974318202E-01 0.36293E-03 -0.86328E-04 15778 0.386E-02 0.156E-01 RMM: 4 -0.204142970304E-01 0.28313E-03 -0.69302E-04 15815 0.377E-02 0.257E-02 RMM: 5 -0.204098993330E-01 0.43977E-05 -0.60738E-05 15838 0.915E-03 0.144E-02 RMM: 6 -0.204220070505E-01 -0.12108E-04 -0.13538E-05 15800 0.498E-03 0.582E-03 RMM: 7 -0.204155840611E-01 0.64230E-05 -0.68754E-06 15836 0.300E-03 0.298E-03 Linear response progress: Degree of freedom: 41/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.304034929518E-01 -0.30403E-01 -0.17696E-02 26798 0.365E-01 RMM: 2 -0.172901137137E-01 0.13113E-01 -0.43395E-03 15255 0.106E-01 0.180E-01 RMM: 3 -0.174611328192E-01 -0.17102E-03 -0.63313E-04 15652 0.327E-02 0.109E-01 RMM: 4 -0.176331594588E-01 -0.17203E-03 -0.44770E-04 15761 0.297E-02 0.245E-02 RMM: 5 -0.176706981404E-01 -0.37539E-04 -0.60647E-05 15829 0.861E-03 0.113E-02 RMM: 6 -0.176887722928E-01 -0.18074E-04 -0.75280E-06 15745 0.427E-03 0.484E-03 RMM: 7 -0.176908973509E-01 -0.21251E-05 -0.33056E-06 15798 0.218E-03 0.235E-03 Linear response progress: Degree of freedom: 42/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.328779984632E-01 -0.32878E-01 -0.30412E-02 26873 0.343E-01 RMM: 2 -0.187983631904E-01 0.14080E-01 -0.42671E-03 15288 0.102E-01 0.186E-01 RMM: 3 -0.189560308316E-01 -0.15767E-03 -0.48105E-04 15591 0.299E-02 0.113E-01 RMM: 4 -0.190323452398E-01 -0.76314E-04 -0.56343E-04 15764 0.319E-02 0.212E-02 RMM: 5 -0.190740503808E-01 -0.41705E-04 -0.45872E-05 15804 0.787E-03 0.972E-03 RMM: 6 -0.190783411414E-01 -0.42908E-05 -0.70753E-06 15852 0.346E-03 0.485E-03 Linear response progress: Degree of freedom: 43/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.325281498750E-01 -0.32528E-01 -0.41671E-02 26101 0.341E-01 RMM: 2 -0.179718004041E-01 0.14556E-01 -0.43594E-03 15475 0.103E-01 0.189E-01 RMM: 3 -0.181847255429E-01 -0.21293E-03 -0.54292E-04 15647 0.321E-02 0.113E-01 RMM: 4 -0.183658514102E-01 -0.18113E-03 -0.64346E-04 15760 0.345E-02 0.237E-02 RMM: 5 -0.184526683988E-01 -0.86817E-04 -0.61911E-05 15743 0.928E-03 0.952E-03 RMM: 6 -0.184650389685E-01 -0.12371E-04 -0.61034E-06 15751 0.375E-03 0.475E-03 RMM: 7 -0.184726866460E-01 -0.76477E-05 -0.21700E-06 15590 0.185E-03 0.201E-03 Linear response progress: Degree of freedom: 44/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.395011174691E-01 -0.39501E-01 -0.63215E-02 26753 0.400E-01 RMM: 2 -0.180570923022E-01 0.21444E-01 -0.55754E-03 15404 0.120E-01 0.210E-01 RMM: 3 -0.182389422277E-01 -0.18185E-03 -0.60353E-04 15575 0.334E-02 0.126E-01 RMM: 4 -0.183593354595E-01 -0.12039E-03 -0.78731E-04 15745 0.392E-02 0.203E-02 RMM: 5 -0.184473806403E-01 -0.88045E-04 -0.77394E-05 15786 0.108E-02 0.116E-02 RMM: 6 -0.184559214675E-01 -0.85408E-05 -0.64320E-06 15806 0.427E-03 0.555E-03 Linear response progress: Degree of freedom: 45/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.447104431706E-01 -0.44710E-01 -0.71359E-02 27009 0.434E-01 RMM: 2 -0.201512532722E-01 0.24559E-01 -0.42153E-03 15407 0.129E-01 0.241E-01 RMM: 3 -0.202192448562E-01 -0.67992E-04 -0.61529E-04 15744 0.353E-02 0.144E-01 RMM: 4 -0.200608745871E-01 0.15837E-03 -0.94254E-04 15842 0.400E-02 0.232E-02 RMM: 5 -0.201018638358E-01 -0.40989E-04 -0.71964E-05 15829 0.100E-02 0.126E-02 RMM: 6 -0.201126579296E-01 -0.10794E-04 -0.15491E-05 15844 0.520E-03 0.548E-03 RMM: 7 -0.201061781952E-01 0.64797E-05 -0.32462E-06 15882 0.228E-03 0.300E-03 Linear response progress: Degree of freedom: 46/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.408280471731E-01 -0.40828E-01 -0.34756E-02 26990 0.441E-01 RMM: 2 -0.199242349144E-01 0.20904E-01 -0.65601E-03 15482 0.133E-01 0.235E-01 RMM: 3 -0.198500870889E-01 0.74148E-04 -0.68574E-04 15786 0.354E-02 0.139E-01 RMM: 4 -0.197425685878E-01 0.10752E-03 -0.78463E-04 15848 0.379E-02 0.215E-02 RMM: 5 -0.197745983417E-01 -0.32030E-04 -0.53482E-05 15860 0.937E-03 0.115E-02 RMM: 6 -0.197799508494E-01 -0.53525E-05 -0.76594E-06 15800 0.441E-03 0.516E-03 Linear response progress: Degree of freedom: 47/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.438615044042E-01 -0.43862E-01 -0.56364E-02 26943 0.451E-01 RMM: 2 -0.197097427465E-01 0.24152E-01 -0.71938E-03 15391 0.141E-01 0.244E-01 RMM: 3 -0.197656108575E-01 -0.55868E-04 -0.69718E-04 15614 0.390E-02 0.143E-01 RMM: 4 -0.197256892972E-01 0.39922E-04 -0.76757E-04 15717 0.405E-02 0.222E-02 RMM: 5 -0.198060238185E-01 -0.80335E-04 -0.85407E-05 15803 0.111E-02 0.124E-02 RMM: 6 -0.198084072873E-01 -0.23835E-05 -0.12208E-05 15762 0.538E-03 0.632E-03 Linear response progress: Degree of freedom: 48/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.352013278733E-01 -0.35201E-01 -0.42233E-02 26848 0.361E-01 RMM: 2 -0.196529781030E-01 0.15548E-01 -0.48774E-03 15300 0.112E-01 0.205E-01 RMM: 3 -0.197060555649E-01 -0.53077E-04 -0.60634E-04 15677 0.339E-02 0.123E-01 RMM: 4 -0.196953453733E-01 0.10710E-04 -0.72681E-04 15822 0.356E-02 0.274E-02 RMM: 5 -0.197656813164E-01 -0.70336E-04 -0.88126E-05 15832 0.104E-02 0.977E-03 RMM: 6 -0.197581888171E-01 0.74925E-05 -0.10552E-05 15831 0.425E-03 0.530E-03 Linear response progress: Degree of freedom: 49/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.344508765350E-01 -0.34451E-01 0.41530E-03 27010 0.416E-01 RMM: 2 -0.201229947307E-01 0.14328E-01 -0.56172E-03 14993 0.124E-01 0.242E-01 RMM: 3 -0.199291448304E-01 0.19385E-03 -0.12269E-03 15643 0.438E-02 0.140E-01 RMM: 4 -0.198936713256E-01 0.35474E-04 -0.34491E-04 15851 0.250E-02 0.689E-02 RMM: 5 -0.198028394131E-01 0.90832E-04 -0.15308E-04 15880 0.183E-02 0.129E-02 RMM: 6 -0.198201981312E-01 -0.17359E-04 -0.71663E-06 15852 0.541E-03 0.650E-03 RMM: 7 -0.198180499163E-01 0.21482E-05 -0.44980E-06 15793 0.335E-03 0.283E-03 Linear response progress: Degree of freedom: 50/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.428712296981E-01 -0.42871E-01 -0.65427E-02 26955 0.431E-01 RMM: 2 -0.197424273352E-01 0.23129E-01 -0.65496E-03 15280 0.131E-01 0.234E-01 RMM: 3 -0.196704318045E-01 0.71996E-04 -0.72969E-04 15678 0.372E-02 0.140E-01 RMM: 4 -0.195967864129E-01 0.73645E-04 -0.80189E-04 15824 0.381E-02 0.299E-02 RMM: 5 -0.196128189838E-01 -0.16033E-04 -0.62179E-05 15816 0.959E-03 0.154E-02 RMM: 6 -0.196475168892E-01 -0.34698E-04 -0.19749E-05 15785 0.562E-03 0.585E-03 RMM: 7 -0.196471705822E-01 0.34631E-06 -0.38598E-06 15835 0.253E-03 0.314E-03 Linear response progress: Degree of freedom: 51/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.316401533904E-01 -0.31640E-01 -0.28694E-02 26558 0.347E-01 RMM: 2 -0.183861451904E-01 0.13254E-01 -0.44608E-03 15268 0.106E-01 0.192E-01 RMM: 3 -0.186744241560E-01 -0.28828E-03 -0.57443E-04 15577 0.338E-02 0.114E-01 RMM: 4 -0.188659387235E-01 -0.19151E-03 -0.47080E-04 15801 0.286E-02 0.326E-02 RMM: 5 -0.188986813510E-01 -0.32743E-04 -0.66290E-05 15815 0.928E-03 0.134E-02 RMM: 6 -0.189259820329E-01 -0.27301E-04 -0.16200E-05 15834 0.413E-03 0.503E-03 RMM: 7 -0.189278358074E-01 -0.18538E-05 -0.28206E-06 15879 0.168E-03 0.246E-03 Linear response progress: Degree of freedom: 52/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.291786821531E-01 -0.29179E-01 -0.33848E-02 26287 0.300E-01 RMM: 2 -0.177340228128E-01 0.11445E-01 -0.35405E-03 15316 0.909E-02 0.174E-01 RMM: 3 -0.178663569449E-01 -0.13233E-03 -0.44023E-04 15751 0.280E-02 0.102E-01 RMM: 4 -0.179119746202E-01 -0.45618E-04 -0.44341E-04 15813 0.275E-02 0.223E-02 RMM: 5 -0.179498799611E-01 -0.37905E-04 -0.33693E-05 15803 0.712E-03 0.864E-03 RMM: 6 -0.179486752674E-01 0.12047E-05 -0.35333E-06 15757 0.296E-03 0.403E-03 Linear response progress: Degree of freedom: 53/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.415208799881E-01 -0.41521E-01 -0.10378E-01 26715 0.362E-01 RMM: 2 -0.182143342309E-01 0.23307E-01 -0.52520E-03 15193 0.111E-01 0.209E-01 RMM: 3 -0.180798379752E-01 0.13450E-03 -0.56699E-04 15696 0.324E-02 0.125E-01 RMM: 4 -0.179297369121E-01 0.15010E-03 -0.56857E-04 15888 0.309E-02 0.252E-02 RMM: 5 -0.179671655527E-01 -0.37429E-04 -0.38871E-05 15818 0.832E-03 0.974E-03 RMM: 6 -0.179732288165E-01 -0.60633E-05 -0.75673E-06 15793 0.397E-03 0.462E-03 Linear response progress: Degree of freedom: 54/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.382063355809E-01 -0.38206E-01 -0.79661E-02 26526 0.352E-01 RMM: 2 -0.184331048958E-01 0.19773E-01 -0.46956E-03 15172 0.107E-01 0.219E-01 RMM: 3 -0.184407895686E-01 -0.76847E-05 -0.60916E-04 15769 0.336E-02 0.129E-01 RMM: 4 -0.183612532073E-01 0.79536E-04 -0.53731E-04 15843 0.300E-02 0.241E-02 RMM: 5 -0.183627264870E-01 -0.14733E-05 -0.38391E-05 15859 0.751E-03 0.104E-02 RMM: 6 -0.183679263869E-01 -0.51999E-05 -0.94036E-06 15758 0.395E-03 0.430E-03 Linear response progress: Degree of freedom: 55/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.333020647838E-01 -0.33302E-01 -0.55763E-02 26525 0.338E-01 RMM: 2 -0.172780383789E-01 0.16024E-01 -0.40347E-03 15060 0.103E-01 0.211E-01 RMM: 3 -0.174561030172E-01 -0.17806E-03 -0.66986E-04 15744 0.339E-02 0.129E-01 RMM: 4 -0.176999008294E-01 -0.24380E-03 -0.64467E-04 15920 0.318E-02 0.272E-02 RMM: 5 -0.177396112943E-01 -0.39710E-04 -0.41735E-05 15818 0.814E-03 0.971E-03 RMM: 6 -0.177426704129E-01 -0.30591E-05 -0.80413E-06 15729 0.355E-03 0.458E-03 Linear response progress: Degree of freedom: 56/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.399218052978E-01 -0.39922E-01 -0.74818E-02 26673 0.385E-01 RMM: 2 -0.180999179416E-01 0.21822E-01 -0.57807E-03 15221 0.120E-01 0.231E-01 RMM: 3 -0.180238563489E-01 0.76062E-04 -0.61495E-04 15772 0.340E-02 0.136E-01 RMM: 4 -0.179295525283E-01 0.94304E-04 -0.52585E-04 15883 0.314E-02 0.240E-02 RMM: 5 -0.179319123493E-01 -0.23598E-05 -0.35369E-05 15825 0.765E-03 0.117E-02 RMM: 6 -0.179401949634E-01 -0.82826E-05 -0.10463E-05 15760 0.448E-03 0.506E-03 Linear response progress: Degree of freedom: 57/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.336926230185E-01 -0.33693E-01 -0.51377E-02 26806 0.361E-01 RMM: 2 -0.166378400948E-01 0.17055E-01 -0.50061E-03 15230 0.111E-01 0.195E-01 RMM: 3 -0.166753330449E-01 -0.37493E-04 -0.55920E-04 15777 0.320E-02 0.115E-01 RMM: 4 -0.167403588279E-01 -0.65026E-04 -0.45134E-04 15876 0.294E-02 0.232E-02 RMM: 5 -0.167831467973E-01 -0.42788E-04 -0.32466E-05 15829 0.725E-03 0.114E-02 RMM: 6 -0.168154356605E-01 -0.32289E-04 -0.80155E-06 15612 0.411E-03 0.415E-03 RMM: 7 -0.168179314586E-01 -0.24958E-05 -0.91116E-07 15864 0.157E-03 0.223E-03 Linear response progress: Degree of freedom: 58/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.437893939430E-01 -0.43789E-01 -0.62101E-02 26870 0.448E-01 RMM: 2 -0.198713841441E-01 0.23918E-01 -0.70696E-03 15594 0.135E-01 0.233E-01 RMM: 3 -0.199743936611E-01 -0.10301E-03 -0.74337E-04 15680 0.389E-02 0.137E-01 RMM: 4 -0.200467049290E-01 -0.72311E-04 -0.79354E-04 15822 0.394E-02 0.218E-02 RMM: 5 -0.201308030654E-01 -0.84098E-04 -0.73600E-05 15823 0.102E-02 0.117E-02 RMM: 6 -0.201499991472E-01 -0.19196E-04 -0.13769E-05 15708 0.623E-03 0.674E-03 RMM: 7 -0.201680695746E-01 -0.18070E-04 -0.32241E-06 15664 0.280E-03 0.279E-03 RMM: 8 -0.201608344342E-01 0.72351E-05 -0.24603E-06 15876 0.185E-03 0.174E-03 Linear response progress: Degree of freedom: 59/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.436978416656E-01 -0.43698E-01 -0.57166E-02 26693 0.444E-01 RMM: 2 -0.200583270785E-01 0.23640E-01 -0.65410E-03 15678 0.133E-01 0.236E-01 RMM: 3 -0.200854612037E-01 -0.27134E-04 -0.75972E-04 15751 0.377E-02 0.138E-01 RMM: 4 -0.200738233826E-01 0.11638E-04 -0.94079E-04 15820 0.408E-02 0.223E-02 RMM: 5 -0.201438417500E-01 -0.70018E-04 -0.98298E-05 15878 0.112E-02 0.118E-02 RMM: 6 -0.201500067701E-01 -0.61650E-05 -0.14838E-05 15852 0.523E-03 0.575E-03 Linear response progress: Degree of freedom: 60/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.456169690055E-01 -0.45617E-01 -0.35376E-02 26897 0.472E-01 RMM: 2 -0.221153961172E-01 0.23502E-01 -0.80340E-03 15645 0.138E-01 0.280E-01 RMM: 3 -0.219350289885E-01 0.18037E-03 -0.92300E-04 15821 0.413E-02 0.162E-01 RMM: 4 -0.217587105676E-01 0.17632E-03 -0.96084E-04 15914 0.415E-02 0.250E-02 RMM: 5 -0.218055919611E-01 -0.46881E-04 -0.64620E-05 15906 0.104E-02 0.130E-02 RMM: 6 -0.218269403205E-01 -0.21348E-04 -0.15212E-05 15798 0.617E-03 0.601E-03 RMM: 7 -0.218321348736E-01 -0.51946E-05 -0.32133E-06 15878 0.269E-03 0.299E-03 Linear response progress: Degree of freedom: 61/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.426212832332E-01 -0.42621E-01 -0.29158E-02 26871 0.452E-01 RMM: 2 -0.201643126292E-01 0.22457E-01 -0.79648E-03 15752 0.142E-01 0.254E-01 RMM: 3 -0.202501585809E-01 -0.85846E-04 -0.81364E-04 15707 0.406E-02 0.148E-01 RMM: 4 -0.203154520018E-01 -0.65293E-04 -0.98293E-04 15685 0.437E-02 0.234E-02 RMM: 5 -0.204247456462E-01 -0.10929E-03 -0.98966E-05 15855 0.123E-02 0.132E-02 RMM: 6 -0.204377245326E-01 -0.12979E-04 -0.18181E-05 15761 0.630E-03 0.700E-03 RMM: 7 -0.204625917585E-01 -0.24867E-04 -0.77992E-06 15673 0.347E-03 0.326E-03 RMM: 8 -0.204586087372E-01 0.39830E-05 -0.24755E-06 15881 0.177E-03 0.208E-03 Linear response progress: Degree of freedom: 62/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.461628348336E-01 -0.46163E-01 -0.68851E-02 26941 0.446E-01 RMM: 2 -0.201157488355E-01 0.26047E-01 -0.77048E-03 15633 0.139E-01 0.241E-01 RMM: 3 -0.201278823793E-01 -0.12134E-04 -0.73107E-04 15812 0.390E-02 0.141E-01 RMM: 4 -0.201482710688E-01 -0.20389E-04 -0.91887E-04 15806 0.417E-02 0.230E-02 RMM: 5 -0.202384083435E-01 -0.90137E-04 -0.97168E-05 15841 0.119E-02 0.126E-02 RMM: 6 -0.202455066761E-01 -0.70983E-05 -0.12884E-05 15787 0.571E-03 0.635E-03 Linear response progress: Degree of freedom: 63/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.461254089295E-01 -0.46125E-01 -0.33518E-02 27100 0.481E-01 RMM: 2 -0.214740512783E-01 0.24651E-01 -0.83018E-03 15715 0.148E-01 0.261E-01 RMM: 3 -0.213555958128E-01 0.11846E-03 -0.80213E-04 15816 0.404E-02 0.152E-01 RMM: 4 -0.212308783187E-01 0.12472E-03 -0.10055E-03 15837 0.433E-02 0.237E-02 RMM: 5 -0.212969917085E-01 -0.66113E-04 -0.11231E-04 15868 0.127E-02 0.129E-02 RMM: 6 -0.212971016346E-01 -0.10993E-06 -0.19369E-05 15846 0.608E-03 0.642E-03 Linear response progress: Degree of freedom: 64/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.408083455238E-01 -0.40808E-01 -0.29628E-02 26837 0.437E-01 RMM: 2 -0.201865103048E-01 0.20622E-01 -0.71051E-03 15570 0.132E-01 0.238E-01 RMM: 3 -0.202088887915E-01 -0.22378E-04 -0.76846E-04 15758 0.375E-02 0.140E-01 RMM: 4 -0.202444371989E-01 -0.35548E-04 -0.82778E-04 15883 0.390E-02 0.268E-02 RMM: 5 -0.202822800690E-01 -0.37843E-04 -0.40780E-05 15813 0.946E-03 0.151E-02 RMM: 6 -0.203184089963E-01 -0.36129E-04 -0.77679E-06 15788 0.522E-03 0.654E-03 RMM: 7 -0.203286608588E-01 -0.10252E-04 -0.69782E-06 15831 0.339E-03 0.328E-03 RMM: 8 -0.203182797086E-01 0.10381E-04 -0.18579E-06 15882 0.207E-03 0.144E-03 RMM: 9 -0.203154978971E-01 0.27818E-05 -0.18494E-06 15931 0.771E-04 0.820E-04 Linear response progress: Degree of freedom: 65/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.527101737836E-01 -0.52710E-01 -0.10948E-01 26982 0.464E-01 RMM: 2 -0.218334982156E-01 0.30877E-01 -0.82478E-03 15404 0.141E-01 0.275E-01 RMM: 3 -0.215004966819E-01 0.33300E-03 -0.98795E-04 15631 0.429E-02 0.160E-01 RMM: 4 -0.213120222904E-01 0.18847E-03 -0.74421E-04 15828 0.359E-02 0.478E-02 RMM: 5 -0.212598573735E-01 0.52165E-04 -0.12759E-04 15839 0.132E-02 0.166E-02 RMM: 6 -0.212954055283E-01 -0.35548E-04 -0.24725E-05 15825 0.625E-03 0.719E-03 RMM: 7 -0.212999211467E-01 -0.45156E-05 -0.85172E-06 15840 0.392E-03 0.358E-03 Linear response progress: Degree of freedom: 66/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.296490858321E-01 -0.29649E-01 0.32859E-02 26868 0.395E-01 RMM: 2 -0.189349479945E-01 0.10714E-01 -0.51883E-03 15595 0.116E-01 0.229E-01 RMM: 3 -0.191807057747E-01 -0.24576E-03 -0.12597E-03 15512 0.439E-02 0.130E-01 RMM: 4 -0.194151121339E-01 -0.23441E-03 -0.29941E-04 15794 0.229E-02 0.701E-02 RMM: 5 -0.195447574463E-01 -0.12965E-03 -0.17953E-04 15833 0.198E-02 0.121E-02 RMM: 6 -0.195956425672E-01 -0.50885E-04 -0.14985E-05 15801 0.527E-03 0.590E-03 RMM: 7 -0.196117842972E-01 -0.16142E-04 -0.31153E-06 15690 0.285E-03 0.254E-03 RMM: 8 -0.196130084645E-01 -0.12242E-05 -0.71097E-07 15830 0.102E-03 0.137E-03 Linear response progress: Degree of freedom: 67/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.471279378846E-01 -0.47128E-01 -0.56317E-02 27068 0.482E-01 RMM: 2 -0.215041231376E-01 0.25624E-01 -0.75798E-03 15679 0.146E-01 0.249E-01 RMM: 3 -0.213520659890E-01 0.15206E-03 -0.85149E-04 15857 0.399E-02 0.148E-01 RMM: 4 -0.211763594334E-01 0.17571E-03 -0.10555E-03 15878 0.428E-02 0.240E-02 RMM: 5 -0.212183646813E-01 -0.42005E-04 -0.83069E-05 15856 0.111E-02 0.130E-02 RMM: 6 -0.212251315640E-01 -0.67669E-05 -0.13448E-05 15896 0.542E-03 0.571E-03 Linear response progress: Degree of freedom: 68/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.461430356744E-01 -0.46143E-01 -0.51428E-02 26993 0.479E-01 RMM: 2 -0.212082979312E-01 0.24935E-01 -0.80869E-03 15648 0.148E-01 0.265E-01 RMM: 3 -0.211839007604E-01 0.24397E-04 -0.92644E-04 15778 0.442E-02 0.154E-01 RMM: 4 -0.211252327395E-01 0.58668E-04 -0.93502E-04 15868 0.427E-02 0.247E-02 RMM: 5 -0.211841230833E-01 -0.58890E-04 -0.10023E-04 15849 0.110E-02 0.134E-02 RMM: 6 -0.211987031140E-01 -0.14580E-04 -0.17762E-05 15727 0.619E-03 0.682E-03 RMM: 7 -0.212131861274E-01 -0.14483E-04 -0.60537E-06 15766 0.331E-03 0.301E-03 RMM: 8 -0.212032404518E-01 0.99457E-05 -0.32263E-06 15848 0.185E-03 0.172E-03 Linear response progress: Degree of freedom: 69/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.412141995899E-01 -0.41214E-01 -0.35410E-02 26929 0.451E-01 RMM: 2 -0.203361240207E-01 0.20878E-01 -0.69199E-03 15702 0.137E-01 0.256E-01 RMM: 3 -0.204433245506E-01 -0.10720E-03 -0.89862E-04 15750 0.420E-02 0.147E-01 RMM: 4 -0.204921143217E-01 -0.48790E-04 -0.83334E-04 15843 0.396E-02 0.248E-02 RMM: 5 -0.205569536226E-01 -0.64839E-04 -0.76094E-05 15819 0.982E-03 0.131E-02 RMM: 6 -0.205867121664E-01 -0.29759E-04 -0.17224E-05 15765 0.580E-03 0.638E-03 RMM: 7 -0.206013768495E-01 -0.14665E-04 -0.44622E-06 15816 0.261E-03 0.291E-03 RMM: 8 -0.205951260193E-01 0.62508E-05 -0.25860E-06 15882 0.170E-03 0.181E-03 Linear response progress: Degree of freedom: 70/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.436164888928E-01 -0.43616E-01 -0.78908E-02 27017 0.420E-01 RMM: 2 -0.198422523839E-01 0.23774E-01 -0.60733E-03 15068 0.127E-01 0.252E-01 RMM: 3 -0.195874094360E-01 0.25484E-03 -0.90985E-04 15528 0.401E-02 0.145E-01 RMM: 4 -0.194231308424E-01 0.16428E-03 -0.51182E-04 15816 0.288E-02 0.568E-02 RMM: 5 -0.193194628796E-01 0.10367E-03 -0.11892E-04 15819 0.142E-02 0.141E-02 RMM: 6 -0.193522797427E-01 -0.32817E-04 -0.19506E-05 15822 0.578E-03 0.609E-03 RMM: 7 -0.193460922909E-01 0.61875E-05 -0.56439E-06 15841 0.325E-03 0.298E-03 Linear response progress: Degree of freedom: 71/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.312903723748E-01 -0.31290E-01 -0.18356E-02 26331 0.351E-01 RMM: 2 -0.179171633992E-01 0.13373E-01 -0.42437E-03 15058 0.104E-01 0.219E-01 RMM: 3 -0.181540642537E-01 -0.23690E-03 -0.52913E-04 15671 0.310E-02 0.131E-01 RMM: 4 -0.183050142799E-01 -0.15095E-03 -0.52068E-04 15849 0.312E-02 0.234E-02 RMM: 5 -0.183387012654E-01 -0.33687E-04 -0.31398E-05 15800 0.752E-03 0.119E-02 RMM: 6 -0.183612098501E-01 -0.22509E-04 -0.94108E-06 15761 0.409E-03 0.505E-03 RMM: 7 -0.183629100726E-01 -0.17002E-05 -0.20529E-06 15824 0.218E-03 0.254E-03 Linear response progress: Degree of freedom: 72/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.272866636343E-01 -0.27287E-01 -0.14207E-03 27012 0.333E-01 RMM: 2 -0.176613846592E-01 0.96253E-02 -0.36510E-03 14918 0.961E-02 0.200E-01 RMM: 3 -0.178830392592E-01 -0.22165E-03 -0.67082E-04 15673 0.320E-02 0.118E-01 RMM: 4 -0.180623795099E-01 -0.17934E-03 -0.31691E-04 15798 0.219E-02 0.520E-02 RMM: 5 -0.180876180148E-01 -0.25239E-04 -0.98990E-05 15832 0.127E-02 0.108E-02 RMM: 6 -0.181002323185E-01 -0.12614E-04 -0.10990E-05 15779 0.419E-03 0.472E-03 RMM: 7 -0.180975534441E-01 0.26789E-05 -0.21785E-06 15813 0.214E-03 0.243E-03 Linear response progress: Degree of freedom: 73/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.414865759499E-01 -0.41487E-01 -0.17406E-02 26921 0.463E-01 RMM: 2 -0.209334601672E-01 0.20553E-01 -0.69225E-03 15503 0.139E-01 0.253E-01 RMM: 3 -0.208774773473E-01 0.55983E-04 -0.88870E-04 15701 0.430E-02 0.146E-01 RMM: 4 -0.208663521354E-01 0.11125E-04 -0.60973E-04 15832 0.350E-02 0.469E-02 RMM: 5 -0.208638699511E-01 0.24822E-05 -0.11133E-04 15802 0.139E-02 0.151E-02 RMM: 6 -0.209023645549E-01 -0.38495E-04 -0.13418E-05 15850 0.562E-03 0.632E-03 RMM: 7 -0.209089943096E-01 -0.66298E-05 -0.12265E-06 15849 0.325E-03 0.281E-03 Linear response progress: Degree of freedom: 74/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.307055966436E-01 -0.30706E-01 0.33044E-02 27012 0.406E-01 RMM: 2 -0.198629507717E-01 0.10843E-01 -0.53288E-03 15520 0.120E-01 0.235E-01 RMM: 3 -0.198681723955E-01 -0.52216E-05 -0.12123E-03 15704 0.430E-02 0.132E-01 RMM: 4 -0.199658536795E-01 -0.97681E-04 -0.41249E-04 15866 0.252E-02 0.637E-02 RMM: 5 -0.199860371395E-01 -0.20183E-04 -0.17972E-04 15866 0.174E-02 0.135E-02 RMM: 6 -0.200082622492E-01 -0.22225E-04 -0.10264E-05 15870 0.525E-03 0.646E-03 RMM: 7 -0.200132130470E-01 -0.49508E-05 0.45531E-06 15883 0.348E-03 0.276E-03 Linear response progress: Degree of freedom: 75/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.505787189312E-01 -0.50579E-01 -0.67992E-02 26707 0.491E-01 RMM: 2 -0.223087785370E-01 0.28270E-01 -0.86922E-03 15572 0.150E-01 0.289E-01 RMM: 3 -0.221719789770E-01 0.13680E-03 -0.99118E-04 15760 0.457E-02 0.164E-01 RMM: 4 -0.220495739323E-01 0.12241E-03 -0.85780E-04 15869 0.406E-02 0.316E-02 RMM: 5 -0.220725423339E-01 -0.22968E-04 -0.84310E-05 15827 0.105E-02 0.153E-02 RMM: 6 -0.221022031414E-01 -0.29661E-04 -0.12643E-05 15856 0.455E-03 0.773E-03 RMM: 7 -0.221204529856E-01 -0.18250E-04 -0.76171E-06 15829 0.408E-03 0.306E-03 RMM: 8 -0.221117162615E-01 0.87367E-05 -0.23705E-06 15886 0.202E-03 0.181E-03 Linear response progress: Degree of freedom: 76/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.347750920956E-01 -0.34775E-01 -0.55081E-02 26345 0.354E-01 RMM: 2 -0.180498864788E-01 0.16725E-01 -0.44712E-03 15458 0.109E-01 0.192E-01 RMM: 3 -0.183079138372E-01 -0.25803E-03 -0.53711E-04 15618 0.337E-02 0.116E-01 RMM: 4 -0.185148768245E-01 -0.20696E-03 -0.68065E-04 15756 0.362E-02 0.239E-02 RMM: 5 -0.185920421909E-01 -0.77165E-04 -0.61214E-05 15792 0.963E-03 0.102E-02 RMM: 6 -0.186028671607E-01 -0.10825E-04 -0.74539E-06 15819 0.441E-03 0.528E-03 RMM: 7 -0.186087274199E-01 -0.58603E-05 -0.17696E-06 15759 0.211E-03 0.250E-03 Linear response progress: Degree of freedom: 77/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.424177664486E-01 -0.42418E-01 -0.59938E-02 26801 0.434E-01 RMM: 2 -0.195473312016E-01 0.22870E-01 -0.63189E-03 15557 0.129E-01 0.243E-01 RMM: 3 -0.195943350539E-01 -0.47004E-04 -0.73393E-04 15667 0.377E-02 0.143E-01 RMM: 4 -0.195687723429E-01 0.25563E-04 -0.87430E-04 15718 0.395E-02 0.224E-02 RMM: 5 -0.196243602022E-01 -0.55588E-04 -0.71233E-05 15788 0.100E-02 0.118E-02 RMM: 6 -0.196344364956E-01 -0.10076E-04 -0.14725E-05 15811 0.491E-03 0.569E-03 RMM: 7 -0.196375975022E-01 -0.31610E-05 -0.63131E-06 15813 0.272E-03 0.289E-03 Linear response progress: Degree of freedom: 78/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.482553105893E-01 -0.48255E-01 -0.93505E-02 26791 0.454E-01 RMM: 2 -0.201879650128E-01 0.28067E-01 -0.71576E-03 15450 0.137E-01 0.242E-01 RMM: 3 -0.200516174929E-01 0.13635E-03 -0.69436E-04 15692 0.373E-02 0.143E-01 RMM: 4 -0.198701097751E-01 0.18151E-03 -0.95343E-04 15838 0.423E-02 0.228E-02 RMM: 5 -0.199355911855E-01 -0.65481E-04 -0.80507E-05 15828 0.114E-02 0.127E-02 RMM: 6 -0.199455969050E-01 -0.10006E-04 -0.10450E-05 15852 0.489E-03 0.591E-03 RMM: 7 -0.199411569201E-01 0.44400E-05 -0.44701E-06 15840 0.285E-03 0.293E-03 Linear response progress: Degree of freedom: 79/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.429598153724E-01 -0.42960E-01 -0.54238E-02 26826 0.440E-01 RMM: 2 -0.195284576252E-01 0.23431E-01 -0.68403E-03 15659 0.135E-01 0.225E-01 RMM: 3 -0.196345228795E-01 -0.10607E-03 -0.71425E-04 15747 0.386E-02 0.132E-01 RMM: 4 -0.197632619560E-01 -0.12874E-03 -0.84342E-04 15779 0.400E-02 0.229E-02 RMM: 5 -0.198447891819E-01 -0.81527E-04 -0.71927E-05 15821 0.104E-02 0.120E-02 RMM: 6 -0.198673507837E-01 -0.22562E-04 -0.13185E-05 15778 0.500E-03 0.572E-03 RMM: 7 -0.198816179520E-01 -0.14267E-04 -0.45327E-06 15743 0.266E-03 0.267E-03 RMM: 8 -0.198727152486E-01 0.89027E-05 -0.20962E-06 15861 0.158E-03 0.119E-03 Linear response progress: Degree of freedom: 80/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.461008298930E-01 -0.46101E-01 -0.44451E-02 26966 0.480E-01 RMM: 2 -0.211561643780E-01 0.24945E-01 -0.81611E-03 15668 0.148E-01 0.262E-01 RMM: 3 -0.210723529037E-01 0.83811E-04 -0.83845E-04 15735 0.420E-02 0.151E-01 RMM: 4 -0.210076999559E-01 0.64653E-04 -0.91951E-04 15834 0.424E-02 0.244E-02 RMM: 5 -0.210745578287E-01 -0.66858E-04 -0.64479E-05 15868 0.108E-02 0.129E-02 RMM: 6 -0.210969067879E-01 -0.22349E-04 -0.14825E-05 15785 0.546E-03 0.605E-03 RMM: 7 -0.211063859303E-01 -0.94791E-05 -0.47317E-06 15780 0.295E-03 0.309E-03 Linear response progress: Degree of freedom: 81/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.490864918881E-01 -0.49086E-01 -0.70159E-02 26996 0.471E-01 RMM: 2 -0.212614787363E-01 0.27825E-01 -0.85523E-03 15520 0.148E-01 0.265E-01 RMM: 3 -0.211193096759E-01 0.14217E-03 -0.86887E-04 15719 0.419E-02 0.154E-01 RMM: 4 -0.209690022369E-01 0.15031E-03 -0.97978E-04 15796 0.427E-02 0.242E-02 RMM: 5 -0.210342394927E-01 -0.65237E-04 -0.10895E-04 15831 0.112E-02 0.134E-02 RMM: 6 -0.210503173234E-01 -0.16078E-04 -0.15758E-05 15826 0.566E-03 0.649E-03 RMM: 7 -0.210632639145E-01 -0.12947E-04 -0.80945E-06 15771 0.338E-03 0.325E-03 RMM: 8 -0.210492334017E-01 0.14031E-04 -0.56003E-06 15883 0.208E-03 0.159E-03 RMM: 9 -0.210468384522E-01 0.23949E-05 -0.84607E-07 15949 0.768E-04 0.838E-04 Linear response progress: Degree of freedom: 82/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.420043351848E-01 -0.42004E-01 -0.67064E-02 26985 0.433E-01 RMM: 2 -0.189061456709E-01 0.23098E-01 -0.61751E-03 15610 0.133E-01 0.219E-01 RMM: 3 -0.190747375985E-01 -0.16859E-03 -0.64181E-04 15710 0.368E-02 0.130E-01 RMM: 4 -0.192257473786E-01 -0.15101E-03 -0.84835E-04 15776 0.415E-02 0.214E-02 RMM: 5 -0.193224329546E-01 -0.96686E-04 -0.82479E-05 15827 0.110E-02 0.116E-02 RMM: 6 -0.193389507803E-01 -0.16518E-04 -0.12346E-05 15828 0.496E-03 0.556E-03 RMM: 7 -0.193515571681E-01 -0.12606E-04 -0.49107E-06 15718 0.287E-03 0.292E-03 RMM: 8 -0.193452073312E-01 0.63498E-05 -0.73839E-07 15885 0.133E-03 0.136E-03 Linear response progress: Degree of freedom: 83/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.434497470655E-01 -0.43450E-01 -0.38287E-02 27036 0.464E-01 RMM: 2 -0.202526329026E-01 0.23197E-01 -0.69060E-03 15612 0.142E-01 0.245E-01 RMM: 3 -0.203279080130E-01 -0.75275E-04 -0.72132E-04 15721 0.390E-02 0.144E-01 RMM: 4 -0.203380500080E-01 -0.10142E-04 -0.10181E-03 15768 0.437E-02 0.228E-02 RMM: 5 -0.204200154351E-01 -0.81965E-04 -0.10934E-04 15815 0.123E-02 0.131E-02 RMM: 6 -0.204261948693E-01 -0.61794E-05 -0.15978E-05 15785 0.529E-03 0.645E-03 Linear response progress: Degree of freedom: 84/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.463310201751E-01 -0.46331E-01 -0.53157E-02 26909 0.475E-01 RMM: 2 -0.210976106314E-01 0.25233E-01 -0.66180E-03 15493 0.143E-01 0.253E-01 RMM: 3 -0.210749182604E-01 0.22692E-04 -0.70108E-04 15687 0.393E-02 0.148E-01 RMM: 4 -0.209504678207E-01 0.12445E-03 -0.87882E-04 15791 0.427E-02 0.226E-02 RMM: 5 -0.210233540197E-01 -0.72886E-04 -0.85085E-05 15818 0.121E-02 0.126E-02 RMM: 6 -0.210257212363E-01 -0.23672E-05 -0.10251E-05 15816 0.520E-03 0.615E-03 Linear response progress: Degree of freedom: 85/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.348042026186E-01 -0.34804E-01 -0.33576E-02 26876 0.373E-01 RMM: 2 -0.192370247356E-01 0.15567E-01 -0.47962E-03 15141 0.106E-01 0.225E-01 RMM: 3 -0.192382925560E-01 -0.12678E-05 -0.60609E-04 15782 0.325E-02 0.131E-01 RMM: 4 -0.192578272045E-01 -0.19535E-04 -0.54860E-04 15912 0.307E-02 0.229E-02 RMM: 5 -0.192684360809E-01 -0.10609E-04 -0.31568E-05 15829 0.757E-03 0.112E-02 RMM: 6 -0.192641172590E-01 0.43188E-05 -0.13000E-05 15739 0.482E-03 0.439E-03 Linear response progress: Degree of freedom: 86/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.380436132543E-01 -0.38044E-01 -0.83499E-02 26563 0.377E-01 RMM: 2 -0.172562929205E-01 0.20787E-01 -0.51023E-03 15347 0.113E-01 0.216E-01 RMM: 3 -0.174074760225E-01 -0.15118E-03 -0.64607E-04 15709 0.341E-02 0.127E-01 RMM: 4 -0.176113786117E-01 -0.20390E-03 -0.66356E-04 15849 0.332E-02 0.216E-02 RMM: 5 -0.176910934947E-01 -0.79715E-04 -0.55352E-05 15820 0.830E-03 0.972E-03 RMM: 6 -0.177152559310E-01 -0.24162E-04 -0.77376E-06 15688 0.385E-03 0.448E-03 RMM: 7 -0.177242687322E-01 -0.90128E-05 -0.94729E-07 15646 0.177E-03 0.223E-03 Linear response progress: Degree of freedom: 87/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.420723144331E-01 -0.42072E-01 -0.62959E-02 26426 0.422E-01 RMM: 2 -0.201634856552E-01 0.21909E-01 -0.68257E-03 15123 0.123E-01 0.258E-01 RMM: 3 -0.200322689012E-01 0.13122E-03 -0.80103E-04 15585 0.381E-02 0.147E-01 RMM: 4 -0.198648177498E-01 0.16745E-03 -0.63005E-04 15794 0.342E-02 0.242E-02 RMM: 5 -0.198933904264E-01 -0.28573E-04 -0.45842E-05 15815 0.798E-03 0.116E-02 RMM: 6 -0.199240309598E-01 -0.30641E-04 -0.10364E-05 15690 0.476E-03 0.525E-03 RMM: 7 -0.199330867019E-01 -0.90557E-05 -0.27509E-06 15811 0.212E-03 0.251E-03 Linear response progress: Degree of freedom: 88/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.450444467923E-01 -0.45044E-01 -0.24820E-02 27055 0.485E-01 RMM: 2 -0.216423956286E-01 0.23402E-01 -0.78007E-03 15656 0.147E-01 0.262E-01 RMM: 3 -0.215470722383E-01 0.95323E-04 -0.82526E-04 15772 0.420E-02 0.152E-01 RMM: 4 -0.214221216576E-01 0.12495E-03 -0.10687E-03 15861 0.438E-02 0.242E-02 RMM: 5 -0.214777464031E-01 -0.55625E-04 -0.10096E-04 15867 0.117E-02 0.128E-02 RMM: 6 -0.214892116299E-01 -0.11465E-04 -0.20058E-05 15846 0.643E-03 0.644E-03 RMM: 7 -0.214966812486E-01 -0.74696E-05 -0.64025E-06 15860 0.315E-03 0.323E-03 Linear response progress: Degree of freedom: 89/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.428216768384E-01 -0.42822E-01 -0.33863E-02 27036 0.461E-01 RMM: 2 -0.204954952931E-01 0.22326E-01 -0.71811E-03 15730 0.141E-01 0.244E-01 RMM: 3 -0.205515560909E-01 -0.56061E-04 -0.78957E-04 15766 0.414E-02 0.141E-01 RMM: 4 -0.205783423946E-01 -0.26786E-04 -0.91521E-04 15850 0.419E-02 0.239E-02 RMM: 5 -0.206510680761E-01 -0.72726E-04 -0.81059E-05 15852 0.114E-02 0.125E-02 RMM: 6 -0.206691444807E-01 -0.18076E-04 -0.20370E-05 15788 0.691E-03 0.693E-03 RMM: 7 -0.206809393894E-01 -0.11795E-04 -0.47707E-06 15864 0.327E-03 0.307E-03 RMM: 8 -0.206705532719E-01 0.10386E-04 -0.18122E-06 15877 0.213E-03 0.209E-03 RMM: 9 -0.206663954257E-01 0.41578E-05 -0.25958E-07 15901 0.102E-03 0.901E-04 Linear response progress: Degree of freedom: 90/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.534229703969E-01 -0.53423E-01 -0.64575E-02 26986 0.514E-01 RMM: 2 -0.228233290815E-01 0.30600E-01 -0.94579E-03 15644 0.161E-01 0.301E-01 RMM: 3 -0.225841363907E-01 0.23919E-03 -0.10221E-03 15744 0.475E-02 0.173E-01 RMM: 4 -0.223210564606E-01 0.26308E-03 -0.11020E-03 15833 0.465E-02 0.267E-02 RMM: 5 -0.223823002031E-01 -0.61244E-04 -0.12932E-04 15877 0.133E-02 0.148E-02 RMM: 6 -0.223897599645E-01 -0.74598E-05 -0.31712E-05 15768 0.856E-03 0.897E-03 Linear response progress: Degree of freedom: 91/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.391265010344E-01 -0.39127E-01 -0.31260E-02 26836 0.432E-01 RMM: 2 -0.194845083431E-01 0.19642E-01 -0.58600E-03 15511 0.129E-01 0.231E-01 RMM: 3 -0.195662648276E-01 -0.81756E-04 -0.62656E-04 15700 0.362E-02 0.135E-01 RMM: 4 -0.196299158329E-01 -0.63651E-04 -0.68260E-04 15815 0.372E-02 0.221E-02 RMM: 5 -0.196841562637E-01 -0.54240E-04 -0.49408E-05 15776 0.921E-03 0.124E-02 RMM: 6 -0.197001129953E-01 -0.15957E-04 -0.31808E-06 15741 0.420E-03 0.632E-03 RMM: 7 -0.197073267694E-01 -0.72138E-05 -0.14537E-06 15798 0.291E-03 0.278E-03 Linear response progress: Degree of freedom: 92/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.431968411881E-01 -0.43197E-01 -0.29948E-02 26859 0.465E-01 RMM: 2 -0.209486676087E-01 0.22248E-01 -0.68999E-03 15461 0.140E-01 0.247E-01 RMM: 3 -0.208686917154E-01 0.79976E-04 -0.84825E-04 15710 0.389E-02 0.144E-01 RMM: 4 -0.207573403575E-01 0.11135E-03 -0.87769E-04 15850 0.404E-02 0.248E-02 RMM: 5 -0.207893492941E-01 -0.32009E-04 -0.69350E-05 15812 0.964E-03 0.142E-02 RMM: 6 -0.208096802507E-01 -0.20331E-04 -0.11886E-05 15760 0.475E-03 0.659E-03 RMM: 7 -0.208155646847E-01 -0.58844E-05 -0.72928E-06 15759 0.319E-03 0.289E-03 Linear response progress: Degree of freedom: 93/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.422718368568E-01 -0.42272E-01 -0.43841E-02 26866 0.445E-01 RMM: 2 -0.201561003684E-01 0.22116E-01 -0.61652E-03 15182 0.133E-01 0.237E-01 RMM: 3 -0.201040710610E-01 0.52029E-04 -0.71479E-04 15662 0.364E-02 0.139E-01 RMM: 4 -0.200420921145E-01 0.61979E-04 -0.80479E-04 15862 0.387E-02 0.246E-02 RMM: 5 -0.200795862064E-01 -0.37494E-04 -0.92097E-05 15795 0.918E-03 0.143E-02 RMM: 6 -0.201021450005E-01 -0.22559E-04 -0.23685E-05 15733 0.522E-03 0.609E-03 RMM: 7 -0.201046686813E-01 -0.25237E-05 -0.17969E-05 15793 0.295E-03 0.296E-03 Linear response progress: Degree of freedom: 94/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.439889250084E-01 -0.43989E-01 -0.34133E-02 27079 0.468E-01 RMM: 2 -0.207090209170E-01 0.23280E-01 -0.82102E-03 15672 0.144E-01 0.248E-01 RMM: 3 -0.206438880626E-01 0.65133E-04 -0.81810E-04 15761 0.395E-02 0.144E-01 RMM: 4 -0.206170747200E-01 0.26813E-04 -0.96418E-04 15849 0.412E-02 0.239E-02 RMM: 5 -0.206824692867E-01 -0.65395E-04 -0.91384E-05 15847 0.116E-02 0.125E-02 RMM: 6 -0.206903958536E-01 -0.79266E-05 -0.16839E-05 15812 0.659E-03 0.663E-03 Linear response progress: Degree of freedom: 95/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.500043749027E-01 -0.50004E-01 -0.71683E-02 26838 0.484E-01 RMM: 2 -0.216602223590E-01 0.28344E-01 -0.86251E-03 15480 0.150E-01 0.270E-01 RMM: 3 -0.215166131651E-01 0.14361E-03 -0.82688E-04 15676 0.423E-02 0.155E-01 RMM: 4 -0.213771748710E-01 0.13944E-03 -0.82227E-04 15845 0.407E-02 0.244E-02 RMM: 5 -0.214314302222E-01 -0.54255E-04 -0.86411E-05 15846 0.108E-02 0.129E-02 RMM: 6 -0.214472701206E-01 -0.15840E-04 -0.21982E-05 15703 0.720E-03 0.754E-03 RMM: 7 -0.214563063833E-01 -0.90363E-05 -0.86087E-06 15825 0.320E-03 0.299E-03 Linear response progress: Degree of freedom: 96/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.428710280997E-01 -0.42871E-01 -0.56563E-02 27090 0.445E-01 RMM: 2 -0.193602996382E-01 0.23511E-01 -0.72170E-03 15579 0.140E-01 0.234E-01 RMM: 3 -0.194887847190E-01 -0.12849E-03 -0.71049E-04 15702 0.400E-02 0.136E-01 RMM: 4 -0.196235339732E-01 -0.13475E-03 -0.77089E-04 15820 0.388E-02 0.231E-02 RMM: 5 -0.197125406687E-01 -0.89007E-04 -0.71859E-05 15843 0.990E-03 0.122E-02 RMM: 6 -0.197527108653E-01 -0.40170E-04 -0.23399E-05 15637 0.745E-03 0.731E-03 RMM: 7 -0.197632706393E-01 -0.10560E-04 -0.56771E-06 15861 0.286E-03 0.293E-03 RMM: 8 -0.197534879744E-01 0.97827E-05 -0.40957E-06 15835 0.209E-03 0.198E-03 Linear response progress: Degree of freedom: 97/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.496583037681E-01 -0.49658E-01 -0.87257E-02 26973 0.467E-01 RMM: 2 -0.214649361569E-01 0.28193E-01 -0.74777E-03 14965 0.142E-01 0.271E-01 RMM: 3 -0.211349895165E-01 0.32995E-03 -0.82663E-04 15660 0.409E-02 0.156E-01 RMM: 4 -0.207304296358E-01 0.40456E-03 -0.78250E-04 15780 0.390E-02 0.239E-02 RMM: 5 -0.207539339199E-01 -0.23504E-04 -0.57714E-05 15794 0.982E-03 0.117E-02 RMM: 6 -0.207599694388E-01 -0.60355E-05 -0.91701E-06 15743 0.489E-03 0.582E-03 Linear response progress: Degree of freedom: 98/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.471357353483E-01 -0.47136E-01 -0.75684E-02 26854 0.456E-01 RMM: 2 -0.209667786842E-01 0.26169E-01 -0.71466E-03 15168 0.140E-01 0.263E-01 RMM: 3 -0.206137337903E-01 0.35304E-03 -0.78520E-04 15722 0.410E-02 0.150E-01 RMM: 4 -0.201911709563E-01 0.42256E-03 -0.82322E-04 15847 0.392E-02 0.244E-02 RMM: 5 -0.202328724511E-01 -0.41701E-04 -0.65541E-05 15810 0.101E-02 0.120E-02 RMM: 6 -0.202450416261E-01 -0.12169E-04 -0.10685E-05 15782 0.480E-03 0.589E-03 RMM: 7 -0.202546712045E-01 -0.96296E-05 -0.61813E-06 15809 0.277E-03 0.267E-03 Linear response progress: Degree of freedom: 99/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.282359134755E-01 -0.28236E-01 -0.31789E-02 26764 0.310E-01 RMM: 2 -0.170360117954E-01 0.11200E-01 -0.31629E-03 15230 0.890E-02 0.194E-01 RMM: 3 -0.174725280283E-01 -0.43652E-03 -0.54586E-04 15717 0.318E-02 0.120E-01 RMM: 4 -0.179356675241E-01 -0.46314E-03 -0.54310E-04 15825 0.298E-02 0.240E-02 RMM: 5 -0.179793521606E-01 -0.43685E-04 -0.34946E-05 15799 0.760E-03 0.753E-03 RMM: 6 -0.179812167352E-01 -0.18646E-05 -0.61012E-06 15805 0.312E-03 0.372E-03 Linear response progress: Degree of freedom: 100/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.455929626140E-01 -0.45593E-01 -0.38734E-02 27037 0.456E-01 RMM: 2 -0.215772988183E-01 0.24016E-01 -0.78917E-03 15556 0.139E-01 0.267E-01 RMM: 3 -0.214835474056E-01 0.93751E-04 -0.75466E-04 15726 0.386E-02 0.155E-01 RMM: 4 -0.213544009308E-01 0.12915E-03 -0.81887E-04 15742 0.385E-02 0.224E-02 RMM: 5 -0.213955633315E-01 -0.41162E-04 -0.94963E-05 15839 0.953E-03 0.126E-02 RMM: 6 -0.214075492924E-01 -0.11986E-04 -0.17932E-05 15795 0.514E-03 0.607E-03 RMM: 7 -0.214136133341E-01 -0.60640E-05 -0.74283E-06 15788 0.301E-03 0.305E-03 Linear response progress: Degree of freedom: 101/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.371533517847E-01 -0.37153E-01 -0.31338E-02 26916 0.406E-01 RMM: 2 -0.185279799486E-01 0.18625E-01 -0.59950E-03 15566 0.123E-01 0.215E-01 RMM: 3 -0.188397049607E-01 -0.31173E-03 -0.58695E-04 15687 0.362E-02 0.125E-01 RMM: 4 -0.191364887049E-01 -0.29678E-03 -0.56359E-04 15704 0.342E-02 0.212E-02 RMM: 5 -0.192208280871E-01 -0.84339E-04 -0.51462E-05 15781 0.833E-03 0.112E-02 RMM: 6 -0.192566393288E-01 -0.35811E-04 -0.93458E-06 15700 0.470E-03 0.557E-03 RMM: 7 -0.192759058615E-01 -0.19267E-04 -0.35371E-06 15742 0.231E-03 0.253E-03 RMM: 8 -0.192701809829E-01 0.57249E-05 -0.16826E-06 15869 0.161E-03 0.145E-03 Linear response progress: Degree of freedom: 102/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.406920328239E-01 -0.40692E-01 0.76648E-03 27085 0.452E-01 RMM: 2 -0.215563999597E-01 0.19136E-01 -0.75400E-03 15535 0.135E-01 0.264E-01 RMM: 3 -0.214627678832E-01 0.93632E-04 -0.69531E-04 15821 0.358E-02 0.155E-01 RMM: 4 -0.213618652828E-01 0.10090E-03 -0.78534E-04 15834 0.387E-02 0.219E-02 RMM: 5 -0.214206683850E-01 -0.58803E-04 -0.54141E-05 15835 0.101E-02 0.122E-02 RMM: 6 -0.214370604917E-01 -0.16392E-04 -0.51119E-06 15802 0.453E-03 0.575E-03 RMM: 7 -0.214410806582E-01 -0.40202E-05 -0.38355E-06 15745 0.289E-03 0.301E-03 Linear response progress: Degree of freedom: 103/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.455866680852E-01 -0.45587E-01 -0.54322E-02 27020 0.468E-01 RMM: 2 -0.207149082857E-01 0.24872E-01 -0.78178E-03 15597 0.144E-01 0.254E-01 RMM: 3 -0.207080789312E-01 0.68294E-05 -0.79705E-04 15742 0.414E-02 0.147E-01 RMM: 4 -0.206968243346E-01 0.11255E-04 -0.10033E-03 15850 0.422E-02 0.237E-02 RMM: 5 -0.207638240412E-01 -0.67000E-04 -0.13319E-04 15827 0.112E-02 0.130E-02 RMM: 6 -0.207768161311E-01 -0.12992E-04 -0.30315E-05 15776 0.578E-03 0.674E-03 RMM: 7 -0.207888178884E-01 -0.12002E-04 -0.13767E-05 15775 0.338E-03 0.340E-03 RMM: 8 -0.207823642395E-01 0.64536E-05 -0.78028E-06 15901 0.204E-03 0.228E-03 Linear response progress: Degree of freedom: 104/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.419249744924E-01 -0.41925E-01 -0.20064E-02 26626 0.457E-01 RMM: 2 -0.205711046696E-01 0.21354E-01 -0.73963E-03 15682 0.140E-01 0.245E-01 RMM: 3 -0.206288277210E-01 -0.57723E-04 -0.77349E-04 15742 0.401E-02 0.143E-01 RMM: 4 -0.206418216152E-01 -0.12994E-04 -0.93490E-04 15811 0.424E-02 0.233E-02 RMM: 5 -0.207245392468E-01 -0.82718E-04 -0.82241E-05 15897 0.114E-02 0.126E-02 RMM: 6 -0.207399913058E-01 -0.15452E-04 -0.16841E-05 15737 0.574E-03 0.633E-03 RMM: 7 -0.207532895982E-01 -0.13298E-04 -0.65881E-06 15791 0.313E-03 0.312E-03 RMM: 8 -0.207475138874E-01 0.57757E-05 -0.11042E-06 15883 0.168E-03 0.185E-03 Linear response progress: Degree of freedom: 105/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.486974037915E-01 -0.48697E-01 -0.68249E-02 26762 0.476E-01 RMM: 2 -0.213457374826E-01 0.27352E-01 -0.84495E-03 15536 0.146E-01 0.262E-01 RMM: 3 -0.212250238682E-01 0.12071E-03 -0.83190E-04 15695 0.417E-02 0.152E-01 RMM: 4 -0.211190682396E-01 0.10596E-03 -0.87126E-04 15845 0.417E-02 0.244E-02 RMM: 5 -0.211816737560E-01 -0.62606E-04 -0.72287E-05 15857 0.107E-02 0.133E-02 RMM: 6 -0.212007409407E-01 -0.19067E-04 -0.93798E-06 15805 0.523E-03 0.669E-03 RMM: 7 -0.212136114960E-01 -0.12871E-04 -0.58333E-06 15764 0.349E-03 0.344E-03 RMM: 8 -0.212062413825E-01 0.73701E-05 -0.28167E-06 15898 0.200E-03 0.216E-03 Linear response progress: Degree of freedom: 106/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.455997058924E-01 -0.45600E-01 -0.19088E-02 26888 0.490E-01 RMM: 2 -0.225259989398E-01 0.23074E-01 -0.83396E-03 15328 0.150E-01 0.289E-01 RMM: 3 -0.222539546666E-01 0.27204E-03 -0.12026E-03 15663 0.490E-02 0.164E-01 RMM: 4 -0.221484407813E-01 0.10551E-03 -0.58790E-04 15869 0.325E-02 0.651E-02 RMM: 5 -0.220648724264E-01 0.83568E-04 -0.17452E-04 15813 0.178E-02 0.154E-02 RMM: 6 -0.221061083076E-01 -0.41236E-04 -0.25535E-05 15820 0.728E-03 0.624E-03 RMM: 7 -0.221049980790E-01 0.11102E-05 -0.32448E-06 15843 0.354E-03 0.312E-03 Linear response progress: Degree of freedom: 107/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.497980937972E-01 -0.49798E-01 -0.80272E-02 26879 0.476E-01 RMM: 2 -0.209449723694E-01 0.28853E-01 -0.86233E-03 15523 0.148E-01 0.269E-01 RMM: 3 -0.208843605314E-01 0.60612E-04 -0.93404E-04 15656 0.451E-02 0.153E-01 RMM: 4 -0.208944442989E-01 -0.10084E-04 -0.83070E-04 15803 0.402E-02 0.274E-02 RMM: 5 -0.209635168575E-01 -0.69073E-04 -0.75987E-05 15841 0.108E-02 0.134E-02 RMM: 6 -0.209934473204E-01 -0.29930E-04 -0.10184E-05 15759 0.514E-03 0.705E-03 RMM: 7 -0.210156290099E-01 -0.22182E-04 -0.67973E-06 15802 0.353E-03 0.331E-03 RMM: 8 -0.210091710919E-01 0.64579E-05 -0.30429E-06 15910 0.222E-03 0.241E-03 Linear response progress: Degree of freedom: 108/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.350322476728E-01 -0.35032E-01 -0.57570E-03 27121 0.422E-01 RMM: 2 -0.196438437328E-01 0.15388E-01 -0.58615E-03 15489 0.126E-01 0.222E-01 RMM: 3 -0.196891780921E-01 -0.45334E-04 -0.96020E-04 15696 0.419E-02 0.128E-01 RMM: 4 -0.198246853770E-01 -0.13551E-03 -0.32840E-04 15822 0.266E-02 0.577E-02 RMM: 5 -0.198770940168E-01 -0.52409E-04 -0.12091E-04 15863 0.169E-02 0.140E-02 RMM: 6 -0.199184858479E-01 -0.41392E-04 -0.67661E-07 15794 0.589E-03 0.605E-03 RMM: 7 -0.199276528528E-01 -0.91670E-05 0.13123E-06 15822 0.339E-03 0.289E-03 Linear response progress: Degree of freedom: 109/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.484998891284E-01 -0.48500E-01 -0.47838E-02 26963 0.475E-01 RMM: 2 -0.222844866174E-01 0.26215E-01 -0.88253E-03 15424 0.150E-01 0.284E-01 RMM: 3 -0.220686692551E-01 0.21582E-03 -0.84849E-04 15824 0.422E-02 0.162E-01 RMM: 4 -0.218347629148E-01 0.23391E-03 -0.85317E-04 15792 0.409E-02 0.256E-02 RMM: 5 -0.218627037781E-01 -0.27941E-04 -0.62435E-05 15892 0.100E-02 0.136E-02 RMM: 6 -0.218796156929E-01 -0.16912E-04 -0.10815E-05 15830 0.488E-03 0.629E-03 RMM: 7 -0.218847996005E-01 -0.51839E-05 -0.56403E-06 15766 0.311E-03 0.284E-03 Linear response progress: Degree of freedom: 110/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.271242354535E-01 -0.27124E-01 0.19797E-02 26574 0.359E-01 RMM: 2 -0.168328284385E-01 0.10291E-01 -0.43808E-03 15628 0.105E-01 0.168E-01 RMM: 3 -0.172517777427E-01 -0.41895E-03 -0.47385E-04 15803 0.297E-02 0.102E-01 RMM: 4 -0.176887598642E-01 -0.43698E-03 -0.46807E-04 15713 0.308E-02 0.201E-02 RMM: 5 -0.177648804872E-01 -0.76121E-04 -0.49356E-05 15807 0.748E-03 0.109E-02 RMM: 6 -0.177979679435E-01 -0.33087E-04 -0.84596E-06 15634 0.366E-03 0.482E-03 RMM: 7 -0.178088453247E-01 -0.10877E-04 -0.31181E-06 15768 0.212E-03 0.192E-03 RMM: 8 -0.178033056510E-01 0.55397E-05 -0.13143E-06 15872 0.115E-03 0.784E-04 Linear response progress: Degree of freedom: 111/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.463131015959E-01 -0.46313E-01 -0.13048E-02 27038 0.474E-01 RMM: 2 -0.224350903978E-01 0.23878E-01 -0.86420E-03 15501 0.150E-01 0.292E-01 RMM: 3 -0.222418713305E-01 0.19322E-03 -0.85705E-04 15756 0.412E-02 0.169E-01 RMM: 4 -0.219845289420E-01 0.25734E-03 -0.87989E-04 15786 0.408E-02 0.245E-02 RMM: 5 -0.220231320550E-01 -0.38603E-04 -0.82649E-05 15858 0.104E-02 0.132E-02 RMM: 6 -0.220368222987E-01 -0.13690E-04 -0.11447E-05 15832 0.474E-03 0.651E-03 RMM: 7 -0.220480068906E-01 -0.11185E-04 -0.69528E-06 15738 0.332E-03 0.293E-03 RMM: 8 -0.220345202946E-01 0.13487E-04 -0.33453E-06 15889 0.189E-03 0.150E-03 RMM: 9 -0.220330700335E-01 0.14503E-05 -0.65145E-07 15889 0.745E-04 0.696E-04 Linear response progress: Degree of freedom: 112/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.375555737639E-01 -0.37556E-01 -0.93718E-03 26927 0.421E-01 RMM: 2 -0.196309231677E-01 0.17925E-01 -0.67318E-03 15622 0.128E-01 0.232E-01 RMM: 3 -0.197626886060E-01 -0.13177E-03 -0.66915E-04 15725 0.352E-02 0.137E-01 RMM: 4 -0.199048278100E-01 -0.14214E-03 -0.88655E-04 15783 0.396E-02 0.210E-02 RMM: 5 -0.199878664554E-01 -0.83039E-04 -0.11087E-04 15794 0.108E-02 0.118E-02 RMM: 6 -0.200016772653E-01 -0.13811E-04 -0.17869E-05 15770 0.434E-03 0.583E-03 RMM: 7 -0.200103047060E-01 -0.86274E-05 -0.76193E-06 15680 0.323E-03 0.290E-03 Linear response progress: Degree of freedom: 113/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.422705769648E-01 -0.42271E-01 -0.31082E-02 27025 0.446E-01 RMM: 2 -0.203276143557E-01 0.21943E-01 -0.75469E-03 15716 0.136E-01 0.246E-01 RMM: 3 -0.203739414303E-01 -0.46327E-04 -0.70780E-04 15726 0.381E-02 0.144E-01 RMM: 4 -0.204164447200E-01 -0.42503E-04 -0.79562E-04 15770 0.409E-02 0.221E-02 RMM: 5 -0.204829596448E-01 -0.66515E-04 -0.58373E-05 15810 0.103E-02 0.129E-02 RMM: 6 -0.205020707975E-01 -0.19111E-04 -0.42826E-06 15781 0.451E-03 0.651E-03 RMM: 7 -0.205131202362E-01 -0.11049E-04 -0.41693E-06 15694 0.361E-03 0.305E-03 RMM: 8 -0.205091432286E-01 0.39770E-05 0.61556E-07 15882 0.145E-03 0.160E-03 Linear response progress: Degree of freedom: 114/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.436614131292E-01 -0.43661E-01 -0.33077E-02 26919 0.443E-01 RMM: 2 -0.209831439093E-01 0.22678E-01 -0.74327E-03 15481 0.136E-01 0.263E-01 RMM: 3 -0.209239357397E-01 0.59208E-04 -0.73508E-04 15702 0.367E-02 0.155E-01 RMM: 4 -0.208381818429E-01 0.85754E-04 -0.95756E-04 15758 0.406E-02 0.224E-02 RMM: 5 -0.208956985398E-01 -0.57517E-04 -0.10191E-04 15838 0.105E-02 0.133E-02 RMM: 6 -0.209134923833E-01 -0.17794E-04 -0.16387E-05 15825 0.469E-03 0.643E-03 RMM: 7 -0.209212242644E-01 -0.77319E-05 -0.58756E-06 15696 0.344E-03 0.303E-03 Linear response progress: Degree of freedom: 115/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.386079322076E-01 -0.38608E-01 -0.16895E-02 26417 0.408E-01 RMM: 2 -0.196846501175E-01 0.18923E-01 -0.55559E-03 15303 0.118E-01 0.178E-01 RMM: 3 -0.196100490880E-01 0.74601E-04 -0.82905E-04 15802 0.321E-02 0.113E-01 RMM: 4 -0.195100160977E-01 0.10003E-03 -0.81643E-04 15983 0.368E-02 0.251E-02 RMM: 5 -0.195283244996E-01 -0.18308E-04 -0.78166E-05 15835 0.910E-03 0.143E-02 RMM: 6 -0.195592669000E-01 -0.30942E-04 -0.25710E-05 15783 0.587E-03 0.509E-03 RMM: 7 -0.195546522596E-01 0.46146E-05 -0.41989E-06 15849 0.221E-03 0.325E-03 Linear response progress: Degree of freedom: 116/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.387640290707E-01 -0.38764E-01 -0.46490E-02 26672 0.407E-01 RMM: 2 -0.184800924340E-01 0.20284E-01 -0.59280E-03 15473 0.120E-01 0.191E-01 RMM: 3 -0.185562250211E-01 -0.76133E-04 -0.70217E-04 15784 0.324E-02 0.117E-01 RMM: 4 -0.186499955007E-01 -0.93770E-04 -0.91665E-04 15910 0.393E-02 0.216E-02 RMM: 5 -0.187085409883E-01 -0.58545E-04 -0.54788E-05 15823 0.902E-03 0.131E-02 RMM: 6 -0.187481669165E-01 -0.39626E-04 -0.16855E-05 15662 0.539E-03 0.464E-03 RMM: 7 -0.187484931647E-01 -0.32625E-06 -0.35060E-06 15817 0.214E-03 0.267E-03 Linear response progress: Degree of freedom: 117/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.303151351192E-01 -0.30315E-01 0.40807E-02 26827 0.391E-01 RMM: 2 -0.199412063040E-01 0.10374E-01 -0.51605E-03 15208 0.112E-01 0.208E-01 RMM: 3 -0.198282206270E-01 0.11299E-03 -0.10759E-03 15813 0.367E-02 0.123E-01 RMM: 4 -0.198337996209E-01 -0.55790E-05 -0.40712E-04 15930 0.238E-02 0.606E-02 RMM: 5 -0.197938228524E-01 0.39977E-04 -0.19559E-04 15894 0.176E-02 0.136E-02 RMM: 6 -0.198112397102E-01 -0.17417E-04 -0.18060E-05 15861 0.502E-03 0.724E-03 RMM: 7 -0.198117112370E-01 -0.47153E-06 -0.92485E-06 15841 0.382E-03 0.309E-03 Linear response progress: Degree of freedom: 118/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.135277683771E-01 -0.13528E-01 -0.75622E-03 18940 0.152E-01 RMM: 2 -0.126028495245E-01 0.92492E-03 -0.85753E-04 15196 0.321E-02 0.105E-01 RMM: 3 -0.120825314663E-01 0.52032E-03 -0.10184E-04 15435 0.111E-02 0.612E-02 RMM: 4 -0.112524533414E-01 0.83008E-03 -0.76194E-05 15103 0.980E-03 0.924E-03 RMM: 5 -0.111629145196E-01 0.89539E-04 -0.35604E-06 15660 0.229E-03 0.213E-03 RMM: 6 -0.111576978848E-01 0.52166E-05 -0.33744E-07 15783 0.729E-04 0.106E-03 Linear response progress: Degree of freedom: 119/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.144673081597E-01 -0.14467E-01 -0.36722E-03 20981 0.167E-01 RMM: 2 -0.131469167089E-01 0.13204E-02 -0.12229E-03 15100 0.401E-02 0.132E-01 RMM: 3 -0.123844355492E-01 0.76248E-03 -0.43776E-04 15238 0.204E-02 0.715E-02 RMM: 4 -0.116423082378E-01 0.74213E-03 -0.13304E-04 15366 0.119E-02 0.223E-02 RMM: 5 -0.113713112863E-01 0.27100E-03 -0.13265E-05 15476 0.405E-03 0.315E-03 RMM: 6 -0.113504869977E-01 0.20824E-04 -0.48511E-07 15798 0.943E-04 0.137E-03 RMM: 7 -0.113525044050E-01 -0.20174E-05 -0.19276E-07 15703 0.556E-04 0.545E-04 Linear response progress: Degree of freedom: 120/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.183878179709E-01 -0.18388E-01 -0.49319E-03 23423 0.194E-01 RMM: 2 -0.147493319246E-01 0.36385E-02 -0.14262E-03 15051 0.491E-02 0.186E-01 RMM: 3 -0.132721812117E-01 0.14772E-02 -0.14450E-03 15153 0.344E-02 0.934E-02 RMM: 4 -0.123458696416E-01 0.92631E-03 -0.26753E-04 15456 0.161E-02 0.351E-02 RMM: 5 -0.119296775027E-01 0.41619E-03 -0.27401E-05 15456 0.557E-03 0.489E-03 RMM: 6 -0.118942102824E-01 0.35467E-04 -0.11018E-06 15772 0.137E-03 0.219E-03 RMM: 7 -0.118869543555E-01 0.72559E-05 -0.29793E-07 15763 0.692E-04 0.852E-04 Linear response progress: Degree of freedom: 121/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.177564049237E-01 -0.17756E-01 -0.71188E-03 23344 0.189E-01 RMM: 2 -0.138888588878E-01 0.38675E-02 -0.14166E-03 15084 0.487E-02 0.173E-01 RMM: 3 -0.126915640827E-01 0.11973E-02 -0.11864E-03 15116 0.312E-02 0.887E-02 RMM: 4 -0.119096593487E-01 0.78190E-03 -0.23949E-04 15366 0.153E-02 0.327E-02 RMM: 5 -0.115763512406E-01 0.33331E-03 -0.24583E-05 15327 0.531E-03 0.424E-03 RMM: 6 -0.115502114252E-01 0.26140E-04 -0.10445E-06 15804 0.121E-03 0.167E-03 RMM: 7 -0.115540156893E-01 -0.38043E-05 -0.31534E-07 15734 0.606E-04 0.685E-04 Linear response progress: Degree of freedom: 122/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.144976641482E-01 -0.14498E-01 -0.23062E-03 21600 0.171E-01 RMM: 2 -0.129193677946E-01 0.15783E-02 -0.12731E-03 15097 0.414E-02 0.133E-01 RMM: 3 -0.122034193816E-01 0.71595E-03 -0.46631E-04 15133 0.210E-02 0.724E-02 RMM: 4 -0.115208689740E-01 0.68255E-03 -0.14079E-04 15279 0.123E-02 0.227E-02 RMM: 5 -0.112708167032E-01 0.25005E-03 -0.13139E-05 15386 0.402E-03 0.327E-03 RMM: 6 -0.112523242867E-01 0.18492E-04 -0.49885E-07 15829 0.947E-04 0.143E-03 RMM: 7 -0.112558933808E-01 -0.35691E-05 -0.21399E-07 15714 0.581E-04 0.573E-04 Linear response progress: Degree of freedom: 123/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.136165799577E-01 -0.13617E-01 -0.95342E-03 19568 0.156E-01 RMM: 2 -0.124039273993E-01 0.12127E-02 -0.10062E-03 15090 0.351E-02 0.112E-01 RMM: 3 -0.119028398630E-01 0.50109E-03 -0.17729E-04 15211 0.142E-02 0.640E-02 RMM: 4 -0.111877216360E-01 0.71512E-03 -0.11578E-04 15095 0.114E-02 0.134E-02 RMM: 5 -0.110691787643E-01 0.11854E-03 -0.92329E-06 15598 0.340E-03 0.260E-03 RMM: 6 -0.110562051717E-01 0.12974E-04 -0.29834E-07 15853 0.789E-04 0.115E-03 RMM: 7 -0.110631440416E-01 -0.69389E-05 -0.16521E-07 15685 0.529E-04 0.470E-04 Linear response progress: Degree of freedom: 124/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.133047964199E-01 -0.13305E-01 -0.70628E-03 19307 0.155E-01 RMM: 2 -0.122652939166E-01 0.10395E-02 -0.69268E-04 15013 0.316E-02 0.980E-02 RMM: 3 -0.118214144665E-01 0.44388E-03 -0.72375E-05 15476 0.974E-03 0.582E-02 RMM: 4 -0.110307962453E-01 0.79062E-03 -0.63074E-05 15388 0.962E-03 0.664E-03 RMM: 5 -0.109889982403E-01 0.41798E-04 -0.24361E-06 15753 0.201E-03 0.257E-03 RMM: 6 -0.109877084383E-01 0.12898E-05 -0.52800E-07 15811 0.896E-04 0.109E-03 Linear response progress: Degree of freedom: 125/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.233921259822E-01 -0.23392E-01 -0.36673E-02 23731 0.206E-01 RMM: 2 -0.146290644404E-01 0.87631E-02 -0.20704E-03 15178 0.551E-02 0.192E-01 RMM: 3 -0.131295740490E-01 0.14995E-02 -0.15768E-03 15180 0.366E-02 0.960E-02 RMM: 4 -0.122676731103E-01 0.86190E-03 -0.26105E-04 15419 0.165E-02 0.369E-02 RMM: 5 -0.118662592411E-01 0.40141E-03 -0.24166E-05 15426 0.565E-03 0.478E-03 RMM: 6 -0.118347579678E-01 0.31501E-04 -0.10563E-06 15784 0.131E-03 0.208E-03 RMM: 7 -0.118316781258E-01 0.30798E-05 -0.44619E-07 15784 0.685E-04 0.793E-04 Linear response progress: Degree of freedom: 126/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.131459221620E-01 -0.13146E-01 -0.89183E-03 19272 0.153E-01 RMM: 2 -0.122360630242E-01 0.90986E-03 -0.79040E-04 15182 0.320E-02 0.102E-01 RMM: 3 -0.117760276229E-01 0.46004E-03 -0.11302E-04 15402 0.116E-02 0.594E-02 RMM: 4 -0.110466834364E-01 0.72934E-03 -0.89197E-05 15003 0.105E-02 0.993E-03 RMM: 5 -0.109668450306E-01 0.79838E-04 -0.49108E-06 15626 0.270E-03 0.225E-03 RMM: 6 -0.109609596389E-01 0.58854E-05 -0.28983E-07 15732 0.757E-04 0.109E-03 Linear response progress: Degree of freedom: 127/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.135560325399E-01 -0.13556E-01 -0.76191E-03 19555 0.153E-01 RMM: 2 -0.125371936652E-01 0.10188E-02 -0.72702E-04 15098 0.316E-02 0.100E-01 RMM: 3 -0.120487591679E-01 0.48843E-03 -0.68590E-05 15364 0.965E-03 0.595E-02 RMM: 4 -0.111790079115E-01 0.86975E-03 -0.66432E-05 15046 0.967E-03 0.609E-03 RMM: 5 -0.111466155942E-01 0.32392E-04 -0.23083E-06 15707 0.206E-03 0.265E-03 RMM: 6 -0.111450567764E-01 0.15588E-05 -0.52290E-07 15744 0.904E-04 0.972E-04 Linear response progress: Degree of freedom: 128/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.132799401862E-01 -0.13280E-01 -0.79290E-03 19001 0.152E-01 RMM: 2 -0.124497966949E-01 0.83014E-03 -0.91366E-04 15184 0.315E-02 0.997E-02 RMM: 3 -0.119787305749E-01 0.47107E-03 -0.68149E-05 15278 0.979E-03 0.591E-02 RMM: 4 -0.111365401127E-01 0.84219E-03 -0.70105E-05 15042 0.979E-03 0.638E-03 RMM: 5 -0.111028616109E-01 0.33679E-04 -0.23913E-06 15708 0.200E-03 0.220E-03 RMM: 6 -0.111002891392E-01 0.25725E-05 -0.49390E-07 15779 0.864E-04 0.831E-04 Linear response progress: Degree of freedom: 129/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.244325975373E-01 -0.24433E-01 -0.41066E-02 23511 0.206E-01 RMM: 2 -0.153196145424E-01 0.91130E-02 -0.19695E-03 14906 0.534E-02 0.205E-01 RMM: 3 -0.135515164217E-01 0.17681E-02 -0.18473E-03 15168 0.394E-02 0.101E-01 RMM: 4 -0.125826066995E-01 0.96891E-03 -0.26195E-04 15478 0.166E-02 0.394E-02 RMM: 5 -0.121056993977E-01 0.47691E-03 -0.26634E-05 15436 0.577E-03 0.456E-03 RMM: 6 -0.120746390978E-01 0.31060E-04 -0.95683E-07 15815 0.126E-03 0.198E-03 RMM: 7 -0.120720841507E-01 0.25549E-05 -0.24678E-07 15797 0.608E-04 0.747E-04 Linear response progress: Degree of freedom: 130/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.146435783236E-01 -0.14644E-01 -0.72588E-03 20063 0.163E-01 RMM: 2 -0.132122482882E-01 0.14313E-02 -0.11360E-03 14813 0.383E-02 0.132E-01 RMM: 3 -0.124612760465E-01 0.75097E-03 -0.36472E-04 15091 0.188E-02 0.723E-02 RMM: 4 -0.117066929350E-01 0.75458E-03 -0.10103E-04 15102 0.108E-02 0.217E-02 RMM: 5 -0.114238630245E-01 0.28283E-03 -0.83127E-06 15377 0.344E-03 0.319E-03 RMM: 6 -0.114109843348E-01 0.12879E-04 -0.47294E-07 15715 0.892E-04 0.153E-03 RMM: 7 -0.114124186751E-01 -0.14343E-05 -0.17570E-07 15681 0.511E-04 0.540E-04 Linear response progress: Degree of freedom: 131/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.197782342298E-01 -0.19778E-01 -0.10027E-02 23268 0.201E-01 RMM: 2 -0.147820472026E-01 0.49962E-02 -0.17027E-03 14911 0.542E-02 0.186E-01 RMM: 3 -0.133727455082E-01 0.14093E-02 -0.13357E-03 14939 0.329E-02 0.942E-02 RMM: 4 -0.125015698312E-01 0.87118E-03 -0.19391E-04 15313 0.143E-02 0.365E-02 RMM: 5 -0.120363217515E-01 0.46525E-03 -0.20557E-05 15238 0.508E-03 0.432E-03 RMM: 6 -0.120071269550E-01 0.29195E-04 -0.73021E-07 15710 0.111E-03 0.192E-03 RMM: 7 -0.120054924970E-01 0.16345E-05 -0.24651E-07 15607 0.621E-04 0.687E-04 Linear response progress: Degree of freedom: 132/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.143981376729E-01 -0.14398E-01 -0.87485E-03 19424 0.159E-01 RMM: 2 -0.130558861756E-01 0.13423E-02 -0.10973E-03 15018 0.375E-02 0.122E-01 RMM: 3 -0.123802593923E-01 0.67563E-03 -0.26875E-04 15138 0.165E-02 0.686E-02 RMM: 4 -0.116130479805E-01 0.76721E-03 -0.87760E-05 15030 0.103E-02 0.183E-02 RMM: 5 -0.113686993888E-01 0.24435E-03 -0.61366E-06 15524 0.307E-03 0.300E-03 RMM: 6 -0.113579988571E-01 0.10701E-04 -0.39867E-07 15693 0.861E-04 0.144E-03 RMM: 7 -0.113595737948E-01 -0.15749E-05 -0.10119E-07 15712 0.457E-04 0.546E-04 Linear response progress: Degree of freedom: 133/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.140640111777E-01 -0.14064E-01 -0.44270E-03 19509 0.159E-01 RMM: 2 -0.130666755095E-01 0.99734E-03 -0.97306E-04 14786 0.361E-02 0.123E-01 RMM: 3 -0.123675166927E-01 0.69916E-03 -0.30416E-04 15029 0.172E-02 0.680E-02 RMM: 4 -0.116404026989E-01 0.72711E-03 -0.80374E-05 15271 0.968E-03 0.206E-02 RMM: 5 -0.113568983521E-01 0.28350E-03 -0.78491E-06 15391 0.331E-03 0.330E-03 RMM: 6 -0.113423771778E-01 0.14521E-04 -0.53128E-07 15721 0.903E-04 0.170E-03 RMM: 7 -0.113419076884E-01 0.46949E-06 -0.18790E-07 15443 0.554E-04 0.560E-04 Linear response progress: Degree of freedom: 134/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.150841862355E-01 -0.15084E-01 -0.51497E-03 20908 0.167E-01 RMM: 2 -0.136421706554E-01 0.14420E-02 -0.12035E-03 14801 0.405E-02 0.142E-01 RMM: 3 -0.126942651739E-01 0.94791E-03 -0.55038E-04 15216 0.221E-02 0.748E-02 RMM: 4 -0.119173646706E-01 0.77690E-03 -0.10672E-04 15367 0.108E-02 0.261E-02 RMM: 5 -0.115478829233E-01 0.36948E-03 -0.11320E-05 15419 0.383E-03 0.328E-03 RMM: 6 -0.115261990469E-01 0.21684E-04 -0.51380E-07 15746 0.904E-04 0.139E-03 RMM: 7 -0.115257577447E-01 0.44130E-06 -0.18826E-07 15630 0.494E-04 0.517E-04 Linear response progress: Degree of freedom: 135/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.194949830890E-01 -0.19495E-01 -0.18710E-02 23197 0.187E-01 RMM: 2 -0.145884533926E-01 0.49065E-02 -0.17425E-03 14786 0.518E-02 0.178E-01 RMM: 3 -0.131900653067E-01 0.13984E-02 -0.12115E-03 15137 0.311E-02 0.899E-02 RMM: 4 -0.123290639794E-01 0.86100E-03 -0.15433E-04 15484 0.130E-02 0.354E-02 RMM: 5 -0.118522964375E-01 0.47677E-03 -0.19772E-05 15435 0.497E-03 0.397E-03 RMM: 6 -0.118233689520E-01 0.28927E-04 -0.59376E-07 15763 0.999E-04 0.189E-03 RMM: 7 -0.118212730222E-01 0.20959E-05 -0.25850E-07 15693 0.614E-04 0.585E-04 Linear response progress: Degree of freedom: 136/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.133607663440E-01 -0.13361E-01 -0.51489E-03 19199 0.148E-01 RMM: 2 -0.125977124142E-01 0.76305E-03 -0.65193E-04 14570 0.302E-02 0.102E-01 RMM: 3 -0.120918389192E-01 0.50587E-03 -0.73146E-05 15264 0.972E-03 0.603E-02 RMM: 4 -0.112298486113E-01 0.86199E-03 -0.66901E-05 15423 0.965E-03 0.700E-03 RMM: 5 -0.111766761936E-01 0.53172E-04 -0.24972E-06 15718 0.199E-03 0.196E-03 RMM: 6 -0.111757257100E-01 0.95048E-06 -0.29340E-07 15786 0.670E-04 0.904E-04 Linear response progress: Degree of freedom: 137/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.225457648122E-01 -0.22546E-01 -0.21835E-02 23211 0.203E-01 RMM: 2 -0.157120040677E-01 0.68338E-02 -0.17162E-03 14285 0.542E-02 0.208E-01 RMM: 3 -0.138674769633E-01 0.18445E-02 -0.17527E-03 14965 0.395E-02 0.102E-01 RMM: 4 -0.128414870829E-01 0.10260E-02 -0.24510E-04 15372 0.166E-02 0.396E-02 RMM: 5 -0.123302582477E-01 0.51123E-03 -0.24239E-05 15419 0.565E-03 0.441E-03 RMM: 6 -0.122945980562E-01 0.35660E-04 -0.69035E-07 15771 0.110E-03 0.183E-03 RMM: 7 -0.122897228523E-01 0.48752E-05 -0.25664E-07 15686 0.597E-04 0.578E-04 Linear response progress: Degree of freedom: 138/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.135464934810E-01 -0.13546E-01 -0.68009E-03 19542 0.152E-01 RMM: 2 -0.125953970486E-01 0.95110E-03 -0.66975E-04 14795 0.313E-02 0.101E-01 RMM: 3 -0.121040680865E-01 0.49133E-03 -0.63141E-05 15436 0.928E-03 0.600E-02 RMM: 4 -0.112113880700E-01 0.89268E-03 -0.62389E-05 15503 0.940E-03 0.536E-03 RMM: 5 -0.111853345917E-01 0.26053E-04 -0.16693E-06 15763 0.174E-03 0.207E-03 RMM: 6 -0.111873823379E-01 -0.20477E-05 -0.38379E-07 15719 0.761E-04 0.782E-04 Linear response progress: Degree of freedom: 139/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.189210776978E-01 -0.18921E-01 -0.15032E-02 23458 0.192E-01 RMM: 2 -0.138975806787E-01 0.50235E-02 -0.16859E-03 14842 0.535E-02 0.172E-01 RMM: 3 -0.127043100432E-01 0.11933E-02 -0.10334E-03 15155 0.310E-02 0.884E-02 RMM: 4 -0.119241290133E-01 0.78018E-03 -0.19661E-04 15445 0.148E-02 0.328E-02 RMM: 5 -0.115705740102E-01 0.35356E-03 -0.18095E-05 15400 0.486E-03 0.389E-03 RMM: 6 -0.115469392534E-01 0.23635E-04 -0.55614E-07 15791 0.975E-04 0.166E-03 RMM: 7 -0.115521620348E-01 -0.52228E-05 -0.28116E-07 15709 0.625E-04 0.525E-04 Linear response progress: Degree of freedom: 140/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.135465082099E-01 -0.13547E-01 -0.58698E-03 20449 0.156E-01 RMM: 2 -0.124797586653E-01 0.10667E-02 -0.97962E-04 14951 0.358E-02 0.118E-01 RMM: 3 -0.119252585266E-01 0.55450E-03 -0.24254E-04 15024 0.163E-02 0.660E-02 RMM: 4 -0.112743602736E-01 0.65090E-03 -0.10148E-04 15209 0.109E-02 0.175E-02 RMM: 5 -0.110898096381E-01 0.18455E-03 -0.70184E-06 15404 0.318E-03 0.267E-03 RMM: 6 -0.110803584853E-01 0.94512E-05 -0.40333E-07 15794 0.821E-04 0.102E-03 Linear response progress: Degree of freedom: 141/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.143314007990E-01 -0.14331E-01 -0.67094E-03 20914 0.164E-01 RMM: 2 -0.127882347867E-01 0.15432E-02 -0.10926E-03 14695 0.402E-02 0.126E-01 RMM: 3 -0.121062247711E-01 0.68201E-03 -0.34326E-04 15147 0.189E-02 0.689E-02 RMM: 4 -0.114368614277E-01 0.66936E-03 -0.95165E-05 15370 0.110E-02 0.213E-02 RMM: 5 -0.111821612490E-01 0.25470E-03 -0.84666E-06 15496 0.353E-03 0.285E-03 RMM: 6 -0.111695322846E-01 0.12629E-04 -0.29416E-07 15800 0.802E-04 0.134E-03 RMM: 7 -0.111745386751E-01 -0.50064E-05 -0.13108E-07 15645 0.530E-04 0.420E-04 Linear response progress: Degree of freedom: 142/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.154254126795E-01 -0.15425E-01 -0.46197E-03 21126 0.161E-01 RMM: 2 -0.134254757485E-01 0.19999E-02 -0.13735E-03 14770 0.409E-02 0.141E-01 RMM: 3 -0.125517663574E-01 0.87371E-03 -0.57276E-04 15291 0.219E-02 0.756E-02 RMM: 4 -0.117791572793E-01 0.77261E-03 -0.14660E-04 15370 0.121E-02 0.250E-02 RMM: 5 -0.114728837025E-01 0.30627E-03 -0.17032E-05 15357 0.428E-03 0.327E-03 RMM: 6 -0.114505023833E-01 0.22381E-04 -0.50614E-07 15734 0.947E-04 0.147E-03 RMM: 7 -0.114516007175E-01 -0.10983E-05 -0.18723E-07 15497 0.622E-04 0.571E-04 Linear response progress: Degree of freedom: 143/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.178516578646E-01 -0.17852E-01 -0.73812E-03 23003 0.183E-01 RMM: 2 -0.144294653874E-01 0.34222E-02 -0.13837E-03 14784 0.454E-02 0.182E-01 RMM: 3 -0.130342533120E-01 0.13952E-02 -0.13686E-03 15271 0.325E-02 0.914E-02 RMM: 4 -0.121526356912E-01 0.88162E-03 -0.25073E-04 15458 0.154E-02 0.337E-02 RMM: 5 -0.117791901743E-01 0.37345E-03 -0.24632E-05 15357 0.515E-03 0.410E-03 RMM: 6 -0.117496480157E-01 0.29542E-04 -0.78633E-07 15753 0.109E-03 0.160E-03 RMM: 7 -0.117525440271E-01 -0.28960E-05 -0.27874E-07 15611 0.605E-04 0.563E-04 Linear response progress: Degree of freedom: 144/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.133591718502E-01 -0.13359E-01 -0.59606E-03 19167 0.148E-01 RMM: 2 -0.124701093244E-01 0.88906E-03 -0.76579E-04 15161 0.307E-02 0.101E-01 RMM: 3 -0.120061920261E-01 0.46392E-03 -0.75478E-05 15293 0.980E-03 0.600E-02 RMM: 4 -0.111674786765E-01 0.83871E-03 -0.69064E-05 14986 0.955E-03 0.653E-03 RMM: 5 -0.111273684596E-01 0.40110E-04 -0.24148E-06 15697 0.202E-03 0.217E-03 RMM: 6 -0.111273819541E-01 -0.13494E-07 -0.52680E-07 15692 0.859E-04 0.943E-04 Linear response progress: Degree of freedom: 145/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.147580339390E-01 -0.14758E-01 -0.28697E-03 20742 0.163E-01 RMM: 2 -0.131998796878E-01 0.15582E-02 -0.13516E-03 14941 0.411E-02 0.129E-01 RMM: 3 -0.124529047601E-01 0.74697E-03 -0.37856E-04 15292 0.187E-02 0.711E-02 RMM: 4 -0.116740412896E-01 0.77886E-03 -0.12674E-04 15156 0.116E-02 0.210E-02 RMM: 5 -0.114142984753E-01 0.25974E-03 -0.13513E-05 15362 0.390E-03 0.296E-03 RMM: 6 -0.113934819708E-01 0.20817E-04 -0.43554E-07 15744 0.879E-04 0.135E-03 RMM: 7 -0.113954017541E-01 -0.19198E-05 -0.22683E-07 15417 0.591E-04 0.496E-04 Linear response progress: Degree of freedom: 146/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.169583492232E-01 -0.16958E-01 -0.32033E-03 22949 0.185E-01 RMM: 2 -0.141717218361E-01 0.27866E-02 -0.17273E-03 15141 0.480E-02 0.168E-01 RMM: 3 -0.129648181916E-01 0.12069E-02 -0.10389E-03 15170 0.292E-02 0.865E-02 RMM: 4 -0.120970078086E-01 0.86781E-03 -0.24511E-04 15294 0.152E-02 0.304E-02 RMM: 5 -0.117559287075E-01 0.34108E-03 -0.23348E-05 15277 0.506E-03 0.417E-03 RMM: 6 -0.117197154154E-01 0.36213E-04 -0.98212E-07 15780 0.119E-03 0.155E-03 RMM: 7 -0.117206158981E-01 -0.90048E-06 -0.28053E-07 15637 0.641E-04 0.579E-04 Linear response progress: Degree of freedom: 147/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.145276412334E-01 -0.14528E-01 -0.22959E-03 20556 0.162E-01 RMM: 2 -0.131065567108E-01 0.14211E-02 -0.12397E-03 15148 0.396E-02 0.127E-01 RMM: 3 -0.123966594876E-01 0.70990E-03 -0.35759E-04 15232 0.183E-02 0.699E-02 RMM: 4 -0.116394395819E-01 0.75722E-03 -0.12031E-04 15178 0.114E-02 0.205E-02 RMM: 5 -0.113891085770E-01 0.25033E-03 -0.12542E-05 15454 0.384E-03 0.293E-03 RMM: 6 -0.113692123542E-01 0.19896E-04 -0.36134E-07 15749 0.859E-04 0.138E-03 RMM: 7 -0.113710060051E-01 -0.17937E-05 -0.20778E-07 15461 0.598E-04 0.500E-04 Linear response progress: Degree of freedom: 148/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.170650640663E-01 -0.17065E-01 -0.51602E-03 22543 0.181E-01 RMM: 2 -0.139151104000E-01 0.31500E-02 -0.17796E-03 15000 0.483E-02 0.161E-01 RMM: 3 -0.128065148891E-01 0.11086E-02 -0.89629E-04 15339 0.280E-02 0.831E-02 RMM: 4 -0.119891814592E-01 0.81733E-03 -0.18883E-04 15457 0.140E-02 0.299E-02 RMM: 5 -0.116332209215E-01 0.35596E-03 -0.20128E-05 15376 0.486E-03 0.392E-03 RMM: 6 -0.116019195163E-01 0.31301E-04 -0.68460E-07 15810 0.111E-03 0.178E-03 RMM: 7 -0.115982508570E-01 0.36687E-05 -0.34279E-07 15778 0.683E-04 0.710E-04 Linear response progress: Degree of freedom: 149/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.160004452966E-01 -0.16000E-01 -0.36094E-03 22936 0.178E-01 RMM: 2 -0.135242142064E-01 0.24762E-02 -0.16256E-03 15259 0.466E-02 0.156E-01 RMM: 3 -0.124890301074E-01 0.10352E-02 -0.87229E-04 15384 0.275E-02 0.809E-02 RMM: 4 -0.117484836008E-01 0.74055E-03 -0.19081E-04 15487 0.140E-02 0.289E-02 RMM: 5 -0.114420357660E-01 0.30645E-03 -0.18971E-05 15414 0.486E-03 0.415E-03 RMM: 6 -0.114167757570E-01 0.25260E-04 -0.72509E-07 15790 0.116E-03 0.195E-03 RMM: 7 -0.114159571266E-01 0.81863E-06 -0.28411E-07 15738 0.639E-04 0.743E-04 Linear response progress: Degree of freedom: 150/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.131436626257E-01 -0.13144E-01 -0.88902E-03 18628 0.148E-01 RMM: 2 -0.122419389703E-01 0.90172E-03 -0.98269E-04 15132 0.311E-02 0.978E-02 RMM: 3 -0.118139405720E-01 0.42800E-03 -0.54911E-05 15437 0.893E-03 0.582E-02 RMM: 4 -0.109895553367E-01 0.82439E-03 -0.68911E-05 15025 0.955E-03 0.521E-03 RMM: 5 -0.109863913645E-01 0.31640E-05 -0.23362E-06 15697 0.199E-03 0.231E-03 RMM: 6 -0.109874561721E-01 -0.10648E-05 -0.68450E-07 15650 0.919E-04 0.850E-04 Linear response progress: Degree of freedom: 151/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.133812225339E-01 -0.13381E-01 -0.86523E-03 19139 0.154E-01 RMM: 2 -0.122949714817E-01 0.10863E-02 -0.80930E-04 15100 0.326E-02 0.997E-02 RMM: 3 -0.118544948774E-01 0.44048E-03 -0.72142E-05 15444 0.986E-03 0.593E-02 RMM: 4 -0.110470147631E-01 0.80748E-03 -0.68855E-05 15281 0.992E-03 0.615E-03 RMM: 5 -0.110118208976E-01 0.35194E-04 -0.20707E-06 15631 0.185E-03 0.273E-03 RMM: 6 -0.110124441130E-01 -0.62322E-06 -0.74944E-07 15756 0.105E-03 0.987E-04 Linear response progress: Degree of freedom: 152/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.148148892715E-01 -0.14815E-01 -0.18810E-03 22267 0.173E-01 RMM: 2 -0.129738176697E-01 0.18411E-02 -0.16055E-03 15265 0.445E-02 0.140E-01 RMM: 3 -0.122082468936E-01 0.76557E-03 -0.56072E-04 15102 0.232E-02 0.749E-02 RMM: 4 -0.115255778657E-01 0.68267E-03 -0.17014E-04 15182 0.133E-02 0.242E-02 RMM: 5 -0.112806469254E-01 0.24493E-03 -0.16099E-05 15378 0.444E-03 0.367E-03 RMM: 6 -0.112604267560E-01 0.20220E-04 -0.62028E-07 15798 0.106E-03 0.166E-03 RMM: 7 -0.112613538369E-01 -0.92708E-06 -0.25117E-07 15538 0.614E-04 0.679E-04 Linear response progress: Degree of freedom: 153/336 N E dE d eps ncg rms rms(c) RMM: 1 -0.181481769571E-01 -0.18148E-01 -0.76158E-03 23362 0.193E-01 RMM: 2 -0.139004764427E-01 0.42477E-02 -0.17681E-03 15195 0.521E-02 0.170E-01 RMM: 3 -0.127422734693E-01 0.11582E-02 -0.10944E-03 15227 0.306E-02 0.875E-02 RMM: 4 -0.119483332885E-01 0.79394E-03 -0.24278E-04 15381 0.156E-02 0.315E-02