N E dE d eps ncg rms rms(c)
DAV: 1 0.665408175830E+04 0.66541E+04 -0.46305E+05 12528 0.106E+03
DAV: 2 -0.153978647672E+04 -0.81939E+04 -0.79545E+04 15380 0.272E+02
DAV: 3 -0.248850218957E+04 -0.94872E+03 -0.94274E+03 15128 0.975E+01
DAV: 4 -0.251478246255E+04 -0.26280E+02 -0.26187E+02 15136 0.175E+01
DAV: 5 -0.251565131634E+04 -0.86885E+00 -0.86773E+00 15352 0.291E+00 0.105E+02
DAV: 6 -0.224356585662E+04 0.27209E+03 -0.10056E+03 14160 0.302E+01 0.488E+01
DAV: 7 -0.223162152513E+04 0.11944E+02 -0.49893E+01 16256 0.763E+00 0.230E+01
DAV: 8 -0.222780710892E+04 0.38144E+01 -0.89633E+00 14856 0.383E+00 0.943E+00
DAV: 9 -0.222700647365E+04 0.80064E+00 -0.21477E+00 15632 0.187E+00 0.219E+00
DAV: 10 -0.222706279104E+04 -0.56317E-01 -0.24941E-01 14424 0.712E-01 0.132E+00
DAV: 11 -0.222710314268E+04 -0.40352E-01 -0.14742E-01 13952 0.586E-01 0.578E-01
DAV: 12 -0.222710406481E+04 -0.92213E-03 -0.31577E-02 16808 0.330E-01 0.334E-01
DAV: 13 -0.222710230644E+04 0.17584E-02 -0.17940E-02 13944 0.232E-01 0.157E-01
DAV: 14 -0.222710108452E+04 0.12219E-02 -0.47831E-03 17664 0.127E-01 0.123E-01
DAV: 15 -0.222709972160E+04 0.13629E-02 -0.16022E-03 14664 0.974E-02 0.585E-02
DAV: 16 -0.222709890072E+04 0.82089E-03 -0.76148E-04 16184 0.887E-02 0.513E-02
DAV: 17 -0.222709874805E+04 0.15267E-03 -0.11803E-03 15664 0.625E-02 0.316E-02
DAV: 18 -0.222709872479E+04 0.23261E-04 -0.29810E-04 14984 0.239E-02 0.260E-02
DAV: 19 -0.222709868682E+04 0.37966E-04 -0.34147E-05 13608 0.157E-02 0.132E-02
DAV: 20 -0.222709867564E+04 0.11180E-04 -0.33942E-05 13464 0.113E-02 0.636E-03
DAV: 21 -0.222709867501E+04 0.63242E-06 -0.19152E-05 9632 0.656E-03
1 F= -.22270987E+04 E0= -.22270987E+04 d E =0.000000E+00
Linear response reoptimize wavefunctions
DAV: 1 -0.222709867415E+04 0.85919E-06 -0.37856E-06 15696 0.276E-03
DAV: 2 -0.222709867421E+04 -0.63577E-07 -0.63578E-07 14728 0.857E-04
DAV: 3 -0.222709867421E+04 -0.12515E-08 -0.12477E-08 8136 0.123E-04
Linear response G [H, r] |phi>, progress :
Direction: 1
N E dE d eps ncg rms
RMM: 1 -0.503546923731E+04 -0.50355E+04 0.27064E+02 31329 0.986E+01
RMM: 2 -0.432183505281E+04 0.71363E+03 -0.60404E+02 22202 0.245E+01
RMM: 3 -0.432961375277E+04 -0.77787E+01 -0.21358E+01 22330 0.409E+00
RMM: 4 -0.433019382016E+04 -0.58007E+00 -0.89657E-01 22965 0.815E-01
RMM: 5 -0.433021671636E+04 -0.22896E-01 -0.85443E-02 23598 0.202E-01
RMM: 6 -0.433021913501E+04 -0.24186E-02 -0.13360E-02 26084 0.610E-02
RMM: 7 -0.433021946201E+04 -0.32700E-03 -0.14851E-02 28962 0.352E-02
RMM: 8 -0.433021946521E+04 -0.32066E-05 -0.12973E-02 29673 0.308E-02
RMM: 9 -0.433021944727E+04 0.17947E-04 -0.13411E-02 29920 0.303E-02
RMM: 10 -0.433021944743E+04 -0.15948E-06 -0.13286E-02 29880 0.303E-02
Linear response G [H, r] |phi>, progress :
Direction: 2
N E dE d eps ncg rms
RMM: 1 -0.505575362717E+04 -0.50558E+04 0.21663E+02 30991 0.989E+01
RMM: 2 -0.432328383715E+04 0.73247E+03 -0.63935E+02 22228 0.245E+01
RMM: 3 -0.433198317919E+04 -0.86993E+01 -0.22358E+01 22381 0.418E+00
RMM: 4 -0.433259216393E+04 -0.60898E+00 -0.96512E-01 22924 0.836E-01
RMM: 5 -0.433261632953E+04 -0.24166E-01 -0.87659E-02 23423 0.209E-01
RMM: 6 -0.433261874199E+04 -0.24125E-02 -0.11331E-02 26031 0.619E-02
RMM: 7 -0.433261908014E+04 -0.33815E-03 -0.90817E-03 28724 0.347E-02
RMM: 8 -0.433261912749E+04 -0.47351E-04 -0.88242E-03 29353 0.300E-02
RMM: 9 -0.433261914869E+04 -0.21201E-04 -0.85029E-03 29592 0.295E-02
RMM: 10 -0.433261913774E+04 0.10956E-04 -0.84247E-03 29560 0.295E-02
Linear response G [H, r] |phi>, progress :
Direction: 3
N E dE d eps ncg rms
RMM: 1 -0.505929283739E+04 -0.50593E+04 0.56552E+01 31326 0.986E+01
RMM: 2 -0.432221643659E+04 0.73708E+03 -0.59406E+02 22228 0.244E+01
RMM: 3 -0.432928868773E+04 -0.70723E+01 -0.20502E+01 22418 0.405E+00
RMM: 4 -0.432983309035E+04 -0.54440E+00 -0.83210E-01 22929 0.798E-01
RMM: 5 -0.432985417778E+04 -0.21087E-01 -0.83649E-02 23557 0.198E-01
RMM: 6 -0.432985627300E+04 -0.20952E-02 -0.16141E-02 26362 0.600E-02
RMM: 7 -0.432985648520E+04 -0.21219E-03 -0.13564E-02 29033 0.354E-02
RMM: 8 -0.432985646676E+04 0.18435E-04 -0.12476E-02 29656 0.312E-02
RMM: 9 -0.432985648372E+04 -0.16955E-04 -0.13076E-02 29898 0.307E-02
RMM: 10 -0.432985648763E+04 -0.39129E-05 -0.13998E-02 29866 0.307E-02
Linear response to external field (no local field effect), progress :
Direction: 1
N E dE d eps ncg rms rms(c)
RMM: 1 -0.222490024456E+02 -0.22249E+02 -0.67020E+01 22187 0.393E+00
RMM: 2 -0.229687022582E+02 -0.71970E+00 -0.72596E-01 22354 0.786E-01
RMM: 3 -0.229777046483E+02 -0.90024E-02 -0.21339E-02 22807 0.115E-01
RMM: 4 -0.229783123793E+02 -0.60773E-03 -0.12216E-03 22849 0.243E-02
RMM: 5 -0.229783464126E+02 -0.34033E-04 -0.11522E-04 22144 0.636E-03
RMM: 6 -0.229783496954E+02 -0.32828E-05 -0.22606E-05 21037 0.236E-03
Linear response to external field (no local field effect), progress :
Direction: 2
N E dE d eps ncg rms rms(c)
RMM: 1 -0.214545298210E+02 -0.21455E+02 -0.63059E+01 22077 0.387E+00
RMM: 2 -0.220717398428E+02 -0.61721E+00 -0.73710E-01 22491 0.777E-01
RMM: 3 -0.220808692488E+02 -0.91294E-02 -0.21508E-02 22845 0.115E-01
RMM: 4 -0.220814793212E+02 -0.61007E-03 -0.12287E-03 22872 0.243E-02
RMM: 5 -0.220815136808E+02 -0.34360E-04 -0.11180E-04 22185 0.639E-03
RMM: 6 -0.220815171843E+02 -0.35036E-05 -0.23680E-05 21089 0.241E-03
Linear response to external field (no local field effect), progress :
Direction: 3
N E dE d eps ncg rms rms(c)
RMM: 1 -0.225198039346E+02 -0.22520E+02 -0.68723E+01 22171 0.394E+00
RMM: 2 -0.232173157753E+02 -0.69751E+00 -0.73282E-01 22417 0.785E-01
RMM: 3 -0.232266561535E+02 -0.93404E-02 -0.22027E-02 22845 0.115E-01
RMM: 4 -0.232272710450E+02 -0.61489E-03 -0.12431E-03 22843 0.245E-02
RMM: 5 -0.232273050099E+02 -0.33965E-04 -0.11171E-04 22137 0.640E-03
RMM: 6 -0.232273085200E+02 -0.35101E-05 -0.22881E-05 21019 0.239E-03
Linear response to external field, progress :
Direction: 1
N E dE d eps ncg rms rms(c)
RMM: 1 -0.222490024456E+02 -0.22249E+02 -0.67020E+01 22187 0.393E+00
RMM: 2 -0.229687022582E+02 -0.71970E+00 -0.72596E-01 22354 0.786E-01 0.846E+00
RMM: 3 -0.180274639938E+02 0.49412E+01 -0.24349E+00 22892 0.121E+00 0.460E+00
RMM: 4 -0.887943289332E+01 0.91480E+01 -0.16738E+00 22832 0.966E-01 0.129E+00
RMM: 5 -0.545242030560E+01 0.34270E+01 -0.15248E-01 22987 0.303E-01 0.652E-01
RMM: 6 -0.412927572510E+01 0.13231E+01 -0.27569E-02 22471 0.146E-01 0.177E-01
RMM: 7 -0.363127957038E+01 0.49800E+00 -0.14601E-02 23572 0.558E-02 0.116E-01
RMM: 8 -0.343267562845E+01 0.19860E+00 -0.65120E-03 23177 0.455E-02 0.463E-02
RMM: 9 -0.343133417850E+01 0.13414E-02 0.11948E-03 24849 0.213E-02 0.298E-02
RMM: 10 -0.346475147214E+01 -0.33417E-01 0.50420E-03 25822 0.136E-02 0.120E-02
RMM: 11 -0.349551869563E+01 -0.30767E-01 0.73797E-03 27807 0.961E-03 0.507E-03
RMM: 12 -0.350639710717E+01 -0.10878E-01 0.83449E-03 30661 0.764E-03 0.260E-03
RMM: 13 -0.350943669523E+01 -0.30396E-02 0.87694E-03 31577 0.725E-03 0.114E-03
RMM: 14 -0.350875826418E+01 0.67843E-03 0.14973E-02 31309 0.711E-03 0.622E-04
RMM: 15 -0.350795231539E+01 0.80595E-03 0.15588E-02 31507 0.709E-03 0.321E-04
RMM: 16 -0.350741438702E+01 0.53793E-03 0.16593E-02 31308 0.708E-03 0.181E-04
RMM: 17 -0.350791031965E+01 -0.49593E-03 0.97984E-03 31424 0.708E-03 0.103E-04
RMM: 18 -0.350749607985E+01 0.41424E-03 0.12997E-02 31494 0.708E-03 0.511E-05
RMM: 19 -0.350764781788E+01 -0.15174E-03 0.12134E-02 31676 0.707E-03 0.327E-05
RMM: 20 -0.350777055353E+01 -0.12274E-03 0.10267E-02 31854 0.707E-03 0.272E-05
RMM: 21 -0.350775700625E+01 0.13547E-04 0.97714E-03 32051 0.707E-03 0.217E-05
RMM: 22 -0.350753152962E+01 0.22548E-03 0.12513E-02 32171 0.707E-03 0.181E-05
RMM: 23 -0.350819013962E+01 -0.65861E-03 0.55616E-03 32307 0.707E-03 0.257E-05
RMM: 24 -0.350767549919E+01 0.51464E-03 0.11263E-02 32416 0.707E-03 0.237E-05
RMM: 25 -0.350797497616E+01 -0.29948E-03 0.94556E-03 32524 0.707E-03 0.317E-05
RMM: 26 -0.350783140835E+01 0.14357E-03 0.10717E-02 32589 0.707E-03 0.342E-05
RMM: 27 -0.350801304450E+01 -0.18164E-03 0.91011E-03 32656 0.707E-03 0.395E-05
RMM: 28 -0.350766236900E+01 0.35068E-03 0.12585E-02 32710 0.707E-03 0.417E-05
RMM: 29 -0.350822297305E+01 -0.56060E-03 0.69581E-03 32753 0.707E-03 0.472E-05
RMM: 30 -0.350768233490E+01 0.54064E-03 0.12557E-02 32804 0.707E-03 0.464E-05
RMM: 31 -0.350816067534E+01 -0.47834E-03 0.77174E-03 32834 0.707E-03 0.509E-05
Linear response to external field, progress :
Direction: 2
N E dE d eps ncg rms rms(c)
RMM: 1 -0.214545298210E+02 -0.21455E+02 -0.63059E+01 22077 0.387E+00
RMM: 2 -0.220717398428E+02 -0.61721E+00 -0.73710E-01 22491 0.777E-01 0.834E+00
RMM: 3 -0.172086335371E+02 0.48631E+01 -0.28986E+00 22898 0.124E+00 0.451E+00
RMM: 4 -0.914778850817E+01 0.80608E+01 -0.16078E+00 22846 0.912E-01 0.146E+00
RMM: 5 -0.520975405558E+01 0.39380E+01 -0.29445E-01 22990 0.346E-01 0.698E-01
RMM: 6 -0.392665984600E+01 0.12831E+01 -0.11437E-01 22723 0.140E-01 0.222E-01
RMM: 7 -0.320354269042E+01 0.72312E+00 -0.80026E-02 23547 0.657E-02 0.126E-01
RMM: 8 -0.297778851321E+01 0.22575E+00 -0.68238E-02 23513 0.513E-02 0.493E-02
RMM: 9 -0.295724385609E+01 0.20545E-01 -0.68507E-02 25420 0.219E-02 0.278E-02
RMM: 10 -0.299993638510E+01 -0.42693E-01 -0.56068E-02 26586 0.143E-02 0.132E-02
RMM: 11 -0.303090053257E+01 -0.30964E-01 -0.63247E-02 28211 0.111E-02 0.508E-03
RMM: 12 -0.304142823175E+01 -0.10528E-01 -0.64870E-02 31059 0.909E-03 0.265E-03
RMM: 13 -0.304553460645E+01 -0.41064E-02 -0.64321E-02 31853 0.874E-03 0.108E-03
RMM: 14 -0.304431847720E+01 0.12161E-02 -0.59402E-02 31718 0.858E-03 0.608E-04
RMM: 15 -0.304427819397E+01 0.40283E-04 -0.64303E-02 31893 0.856E-03 0.323E-04
RMM: 16 -0.304435003504E+01 -0.71841E-04 -0.68756E-02 31707 0.855E-03 0.178E-04
RMM: 17 -0.304392347271E+01 0.42656E-03 -0.65696E-02 31813 0.855E-03 0.101E-04
RMM: 18 -0.304375808014E+01 0.16539E-03 -0.62650E-02 31905 0.855E-03 0.663E-05
RMM: 19 -0.304401204627E+01 -0.25397E-03 -0.64772E-02 32064 0.855E-03 0.500E-05
RMM: 20 -0.304380960548E+01 0.20244E-03 -0.63259E-02 32190 0.855E-03 0.437E-05
RMM: 21 -0.304382201707E+01 -0.12412E-04 -0.63207E-02 32384 0.855E-03 0.364E-05
RMM: 22 -0.304408114834E+01 -0.25913E-03 -0.66370E-02 32506 0.855E-03 0.390E-05
RMM: 23 -0.304392017120E+01 0.16098E-03 -0.64167E-02 32670 0.855E-03 0.311E-05
RMM: 24 -0.304389920305E+01 0.20968E-04 -0.64190E-02 32792 0.855E-03 0.342E-05
RMM: 25 -0.304387684591E+01 0.22357E-04 -0.64223E-02 32927 0.855E-03 0.383E-05
RMM: 26 -0.304431054202E+01 -0.43370E-03 -0.66695E-02 33005 0.855E-03 0.495E-05
RMM: 27 -0.304395750708E+01 0.35303E-03 -0.64733E-02 33125 0.855E-03 0.473E-05
RMM: 28 -0.304384162107E+01 0.11589E-03 -0.63550E-02 33192 0.855E-03 0.536E-05
RMM: 29 -0.304419452265E+01 -0.35290E-03 -0.67141E-02 33249 0.855E-03 0.563E-05
RMM: 30 -0.304373667169E+01 0.45785E-03 -0.62264E-02 33306 0.855E-03 0.612E-05
RMM: 31 -0.304368395112E+01 0.52721E-04 -0.61488E-02 33341 0.855E-03 0.636E-05
RMM: 32 -0.304411018554E+01 -0.42623E-03 -0.66062E-02 33368 0.855E-03 0.674E-05
Linear response to external field, progress :
Direction: 3
N E dE d eps ncg rms rms(c)
RMM: 1 -0.225198039346E+02 -0.22520E+02 -0.68723E+01 22171 0.394E+00
RMM: 2 -0.232173157753E+02 -0.69751E+00 -0.73282E-01 22417 0.785E-01 0.850E+00
RMM: 3 -0.183723377307E+02 0.48450E+01 -0.22607E+00 22902 0.118E+00 0.466E+00
RMM: 4 -0.937782137420E+01 0.89945E+01 -0.15102E+00 22828 0.947E-01 0.137E+00
RMM: 5 -0.585018265863E+01 0.35276E+01 -0.14426E-01 23004 0.303E-01 0.667E-01
RMM: 6 -0.458952761407E+01 0.12607E+01 -0.25811E-02 22645 0.132E-01 0.184E-01
RMM: 7 -0.401547231275E+01 0.57406E+00 -0.33323E-03 23494 0.522E-02 0.110E-01
RMM: 8 -0.382470451780E+01 0.19077E+00 -0.21178E-03 23105 0.403E-02 0.428E-02
RMM: 9 -0.377480577202E+01 0.49899E-01 -0.84197E-04 24577 0.194E-02 0.274E-02
RMM: 10 -0.380713725186E+01 -0.32331E-01 -0.12917E-03 25324 0.126E-02 0.126E-02
RMM: 11 -0.383443649931E+01 -0.27299E-01 -0.44130E-03 26841 0.882E-03 0.541E-03
RMM: 12 -0.384671930451E+01 -0.12283E-01 -0.76863E-03 29169 0.672E-03 0.263E-03
RMM: 13 -0.384969445127E+01 -0.29751E-02 -0.85388E-03 30425 0.619E-03 0.106E-03
RMM: 14 -0.384960420671E+01 0.90245E-04 -0.86355E-03 30184 0.601E-03 0.579E-04
RMM: 15 -0.384847333424E+01 0.11309E-02 -0.60726E-03 30396 0.599E-03 0.279E-04
RMM: 16 -0.384808642288E+01 0.38691E-03 -0.54939E-03 30200 0.598E-03 0.157E-04
RMM: 17 -0.384818337693E+01 -0.96954E-04 -0.74348E-03 30395 0.598E-03 0.796E-05
RMM: 18 -0.384831350641E+01 -0.13013E-03 -0.88737E-03 30590 0.598E-03 0.468E-05
RMM: 19 -0.384845024784E+01 -0.13674E-03 -0.96404E-03 30765 0.598E-03 0.343E-05
RMM: 20 -0.384835758977E+01 0.92658E-04 -0.10220E-02 30934 0.598E-03 0.266E-05
RMM: 21 -0.384829380851E+01 0.63781E-04 -0.11468E-02 31172 0.598E-03 0.410E-05
RMM: 22 -0.384826517956E+01 0.28629E-04 -0.21148E-02 31290 0.598E-03 0.554E-05
RMM: 23 -0.384848580634E+01 -0.22063E-03 -0.21770E-02 31482 0.597E-03 0.658E-05
RMM: 24 -0.384853976058E+01 -0.53954E-04 -0.16922E-02 31632 0.597E-03 0.725E-05
RMM: 25 -0.384861619145E+01 -0.76431E-04 -0.16853E-02 31796 0.597E-03 0.766E-05
RMM: 26 -0.384863135037E+01 -0.15159E-04 -0.17015E-02 31917 0.597E-03 0.827E-05
RMM: 27 -0.384867176485E+01 -0.40414E-04 -0.17288E-02 32037 0.597E-03 0.852E-05
RMM: 28 -0.384864344615E+01 0.28319E-04 -0.17314E-02 32158 0.597E-03 0.914E-05
Linear response DOF= 1104
Linear response progress:
Degree of freedom: 1/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.873803282989E-02 -0.87380E-02 -0.17097E-02 34794 0.147E-01
RMM: 2 -0.223297920038E-03 0.85147E-02 -0.34549E-03 21719 0.462E-02 0.119E-01
RMM: 3 -0.281070552730E-02 -0.25874E-02 -0.30472E-04 22841 0.125E-02 0.737E-02
RMM: 4 -0.496681056077E-02 -0.21561E-02 -0.33892E-04 22882 0.148E-02 0.176E-02
RMM: 5 -0.518328153731E-02 -0.21647E-03 0.57734E-05 22964 0.420E-03 0.793E-03
RMM: 6 -0.519761709949E-02 -0.14336E-04 0.10961E-04 23402 0.172E-03 0.394E-03
RMM: 7 -0.513180772866E-02 0.65809E-04 0.12514E-04 23350 0.120E-03 0.175E-03
RMM: 8 -0.510871164897E-02 0.23096E-04 0.13389E-04 24798 0.519E-04 0.834E-04
RMM: 9 -0.509432650150E-02 0.14385E-04 0.13410E-04 25434 0.402E-04 0.433E-04
RMM: 10 -0.509721152615E-02 -0.28850E-05 0.13956E-04 27839 0.248E-04 0.150E-04
RMM: 11 -0.509768799016E-02 -0.47646E-06 0.14272E-04 31210 0.189E-04 0.877E-05
RMM: 12 -0.509652075819E-02 0.11672E-05 0.14988E-04 31770 0.179E-04 0.302E-05
RMM: 13 -0.509616831763E-02 0.35244E-06 0.15216E-04 32270 0.174E-04 0.155E-05
Linear response progress:
Degree of freedom: 2/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.205833179647E-01 -0.20583E-01 -0.70090E-02 36852 0.196E-01
RMM: 2 -0.225686259733E-02 0.18326E-01 -0.55249E-03 21118 0.633E-02 0.184E-01
RMM: 3 -0.408273157540E-02 -0.18259E-02 -0.52283E-04 22823 0.167E-02 0.113E-01
RMM: 4 -0.527916906333E-02 -0.11964E-02 -0.75492E-04 23064 0.188E-02 0.198E-02
RMM: 5 -0.551484013865E-02 -0.23567E-03 -0.26524E-04 23080 0.552E-03 0.945E-03
RMM: 6 -0.551420473963E-02 0.63540E-06 -0.24460E-04 23579 0.206E-03 0.522E-03
RMM: 7 -0.545604181028E-02 0.58163E-04 -0.26437E-04 23683 0.137E-03 0.227E-03
RMM: 8 -0.540327567327E-02 0.52766E-04 -0.27561E-04 24726 0.817E-04 0.107E-03
RMM: 9 -0.538222502478E-02 0.21051E-04 -0.26226E-04 26062 0.531E-04 0.560E-04
RMM: 10 -0.537662207564E-02 0.56029E-05 -0.23624E-04 27641 0.383E-04 0.184E-04
RMM: 11 -0.537562669484E-02 0.99538E-06 -0.21578E-04 31447 0.287E-04 0.107E-04
RMM: 12 -0.537634581088E-02 -0.71912E-06 -0.21430E-04 32181 0.273E-04 0.442E-05
RMM: 13 -0.537736732778E-02 -0.10215E-05 -0.22274E-04 33009 0.265E-04 0.235E-05
Linear response progress:
Degree of freedom: 3/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.194791168602E-01 -0.19479E-01 -0.53069E-02 36977 0.186E-01
RMM: 2 -0.346272574421E-02 0.16016E-01 -0.49797E-03 20978 0.613E-02 0.166E-01
RMM: 3 -0.512654858874E-02 -0.16638E-02 -0.41454E-04 22770 0.157E-02 0.101E-01
RMM: 4 -0.602933362474E-02 -0.90279E-03 -0.60732E-04 23004 0.176E-02 0.199E-02
RMM: 5 -0.630334063807E-02 -0.27401E-03 -0.15201E-04 23040 0.536E-03 0.924E-03
RMM: 6 -0.626335672797E-02 0.39984E-04 -0.11302E-04 23531 0.203E-03 0.487E-03
RMM: 7 -0.621325648947E-02 0.50100E-04 -0.12751E-04 23568 0.134E-03 0.208E-03
RMM: 8 -0.617341657301E-02 0.39840E-04 -0.13802E-04 24767 0.698E-04 0.109E-03
RMM: 9 -0.616124788450E-02 0.12169E-04 -0.15853E-04 25651 0.506E-04 0.540E-04
RMM: 10 -0.616338051226E-02 -0.21326E-05 -0.17418E-04 27479 0.332E-04 0.194E-04
RMM: 11 -0.616753828429E-02 -0.41578E-05 -0.19069E-04 31039 0.249E-04 0.102E-04
RMM: 12 -0.617036657640E-02 -0.28283E-05 -0.20511E-04 31962 0.234E-04 0.460E-05
RMM: 13 -0.617139298693E-02 -0.10264E-05 -0.21447E-04 32685 0.227E-04 0.208E-05
Linear response progress:
Degree of freedom: 4/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.354332674297E-01 -0.35433E-01 -0.12416E-01 36610 0.244E-01
RMM: 2 -0.564417894032E-02 0.29789E-01 -0.96863E-03 21544 0.790E-02 0.223E-01
RMM: 3 -0.691434176155E-02 -0.12702E-02 -0.80498E-04 22961 0.197E-02 0.134E-01
RMM: 4 -0.749133992033E-02 -0.57700E-03 -0.74784E-04 23136 0.220E-02 0.205E-02
RMM: 5 -0.777389904851E-02 -0.28256E-03 -0.29748E-05 23093 0.577E-03 0.122E-02
RMM: 6 -0.783092800133E-02 -0.57029E-04 0.40304E-05 23396 0.289E-03 0.575E-03
RMM: 7 -0.777586861444E-02 0.55059E-04 0.60205E-05 23785 0.159E-03 0.297E-03
RMM: 8 -0.769284730079E-02 0.83021E-04 0.70896E-05 24275 0.115E-03 0.102E-03
RMM: 9 -0.768624947749E-02 0.65978E-05 0.73531E-05 26452 0.508E-04 0.533E-04
Linear response progress:
Degree of freedom: 5/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.135550875402E-01 -0.13555E-01 -0.21827E-02 35873 0.172E-01
RMM: 2 -0.205982395136E-02 0.11495E-01 -0.45226E-03 22096 0.564E-02 0.148E-01
RMM: 3 -0.473513849766E-02 -0.26753E-02 -0.42372E-04 22867 0.153E-02 0.891E-02
RMM: 4 -0.671194288390E-02 -0.19768E-02 -0.62861E-04 22955 0.172E-02 0.221E-02
RMM: 5 -0.708031103543E-02 -0.36837E-03 -0.24190E-04 22975 0.534E-03 0.957E-03
RMM: 6 -0.705385654951E-02 0.26454E-04 -0.20323E-04 23220 0.235E-03 0.490E-03
RMM: 7 -0.701984406764E-02 0.34012E-04 -0.22348E-04 23258 0.134E-03 0.188E-03
RMM: 8 -0.698310150759E-02 0.36743E-04 -0.23646E-04 24384 0.677E-04 0.108E-03
RMM: 9 -0.696214218599E-02 0.20959E-04 -0.24831E-04 24861 0.520E-04 0.503E-04
RMM: 10 -0.696311070684E-02 -0.96852E-06 -0.26305E-04 27078 0.271E-04 0.178E-04
RMM: 11 -0.696500041099E-02 -0.18897E-05 -0.26781E-04 30546 0.193E-04 0.107E-04
RMM: 12 -0.696569951396E-02 -0.69910E-06 -0.26886E-04 31562 0.180E-04 0.474E-05
RMM: 13 -0.696612147359E-02 -0.42196E-06 -0.27309E-04 32289 0.173E-04 0.197E-05
RMM: 14 -0.696570420905E-02 0.41726E-06 -0.26693E-04 32349 0.170E-04 0.102E-05
Linear response progress:
Degree of freedom: 6/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.196431631060E-01 -0.19643E-01 -0.53642E-02 37219 0.196E-01
RMM: 2 -0.300571965394E-02 0.16637E-01 -0.54806E-03 21841 0.647E-02 0.172E-01
RMM: 3 -0.498167959937E-02 -0.19760E-02 -0.54855E-04 22807 0.173E-02 0.105E-01
RMM: 4 -0.620757666924E-02 -0.12259E-02 -0.74209E-04 23045 0.195E-02 0.218E-02
RMM: 5 -0.656930107218E-02 -0.36172E-03 -0.17395E-04 23031 0.563E-03 0.940E-03
RMM: 6 -0.656789092775E-02 0.14101E-05 -0.12355E-04 23395 0.234E-03 0.498E-03
RMM: 7 -0.655742832116E-02 0.10463E-04 -0.11122E-04 23616 0.127E-03 0.226E-03
RMM: 8 -0.650397143860E-02 0.53457E-04 -0.90937E-05 24387 0.863E-04 0.110E-03
RMM: 9 -0.648794205921E-02 0.16029E-04 -0.75851E-05 25483 0.543E-04 0.536E-04
RMM: 10 -0.648659161110E-02 0.13504E-05 -0.97657E-05 27237 0.341E-04 0.201E-04
Linear response progress:
Degree of freedom: 7/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.205072049579E-01 -0.20507E-01 -0.44308E-02 36691 0.210E-01
RMM: 2 -0.316871047580E-02 0.17338E-01 -0.59615E-03 21740 0.671E-02 0.183E-01
RMM: 3 -0.550317537285E-02 -0.23345E-02 -0.60197E-04 22824 0.180E-02 0.112E-01
RMM: 4 -0.731901764142E-02 -0.18158E-02 -0.99138E-04 23024 0.210E-02 0.210E-02
RMM: 5 -0.772902108870E-02 -0.41000E-03 -0.36019E-04 23073 0.610E-03 0.961E-03
RMM: 6 -0.775906990808E-02 -0.30049E-04 -0.34508E-04 23507 0.240E-03 0.510E-03
RMM: 7 -0.773138447835E-02 0.27685E-04 -0.39669E-04 23829 0.130E-03 0.249E-03
RMM: 8 -0.767968216012E-02 0.51702E-04 -0.43793E-04 24551 0.859E-04 0.111E-03
RMM: 9 -0.766239007177E-02 0.17292E-04 -0.47512E-04 25855 0.547E-04 0.577E-04
RMM: 10 -0.765806876716E-02 0.43213E-05 -0.50502E-04 27737 0.372E-04 0.184E-04
RMM: 11 -0.766227301768E-02 -0.42043E-05 -0.52844E-04 31563 0.278E-04 0.939E-05
RMM: 12 -0.766392393976E-02 -0.16509E-05 -0.54283E-04 32461 0.263E-04 0.389E-05
RMM: 13 -0.766345273061E-02 0.47121E-06 -0.53608E-04 33108 0.256E-04 0.185E-05
Linear response progress:
Degree of freedom: 8/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.293984084409E-01 -0.29398E-01 -0.82375E-02 36946 0.240E-01
RMM: 2 -0.479052404591E-02 0.24608E-01 -0.71440E-03 21680 0.763E-02 0.212E-01
RMM: 3 -0.680438171212E-02 -0.20139E-02 -0.25192E-04 22714 0.202E-02 0.126E-01
RMM: 4 -0.835404033245E-02 -0.15497E-02 -0.19971E-04 22971 0.225E-02 0.209E-02
RMM: 5 -0.884047274137E-02 -0.48643E-03 0.63833E-04 23042 0.635E-03 0.116E-02
RMM: 6 -0.890042843245E-02 -0.59956E-04 0.73663E-04 23370 0.265E-03 0.601E-03
RMM: 7 -0.888292525078E-02 0.17503E-04 0.68816E-04 23520 0.168E-03 0.306E-03
RMM: 8 -0.882947602932E-02 0.53449E-04 0.65476E-04 24183 0.108E-03 0.107E-03
RMM: 9 -0.882207008421E-02 0.74059E-05 0.63952E-04 26086 0.529E-04 0.666E-04
RMM: 10 -0.881542067781E-02 0.66494E-05 0.64632E-04 27223 0.390E-04 0.238E-04
RMM: 11 -0.881989541515E-02 -0.44747E-05 0.63438E-04 30307 0.290E-04 0.105E-04
RMM: 12 -0.882046995142E-02 -0.57454E-06 0.63745E-04 31911 0.261E-04 0.520E-05
RMM: 13 -0.882026103679E-02 0.20891E-06 0.64142E-04 32441 0.254E-04 0.228E-05
RMM: 14 -0.881996625915E-02 0.29478E-06 0.64304E-04 32678 0.252E-04 0.112E-05
Linear response progress:
Degree of freedom: 9/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.283586930647E-01 -0.28359E-01 -0.76737E-02 37189 0.236E-01
RMM: 2 -0.532883858862E-02 0.23030E-01 -0.69944E-03 21874 0.754E-02 0.208E-01
RMM: 3 -0.742739535621E-02 -0.20986E-02 -0.53935E-04 22932 0.197E-02 0.126E-01
RMM: 4 -0.906999807090E-02 -0.16426E-02 -0.10660E-03 23039 0.225E-02 0.214E-02
RMM: 5 -0.952257853855E-02 -0.45258E-03 -0.32786E-04 23098 0.655E-03 0.109E-02
RMM: 6 -0.955283059258E-02 -0.30252E-04 -0.28998E-04 23520 0.267E-03 0.569E-03
RMM: 7 -0.953911959602E-02 0.13711E-04 -0.36585E-04 23805 0.158E-03 0.290E-03
RMM: 8 -0.949403743959E-02 0.45082E-04 -0.43822E-04 24539 0.108E-03 0.109E-03
RMM: 9 -0.949119367001E-02 0.28438E-05 -0.49908E-04 26336 0.588E-04 0.674E-04
RMM: 10 -0.949296445042E-02 -0.17708E-05 -0.56715E-04 27877 0.444E-04 0.256E-04
RMM: 11 -0.949844370324E-02 -0.54793E-05 -0.59958E-04 30647 0.352E-04 0.113E-04
RMM: 12 -0.950198693513E-02 -0.35432E-05 -0.62612E-04 32334 0.322E-04 0.505E-05
RMM: 13 -0.950296213571E-02 -0.97520E-06 -0.63356E-04 32958 0.315E-04 0.244E-05
RMM: 14 -0.950241366559E-02 0.54847E-06 -0.62888E-04 33056 0.312E-04 0.136E-05
Linear response progress:
Degree of freedom: 10/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.300291036300E-01 -0.30029E-01 -0.96820E-02 36781 0.229E-01
RMM: 2 -0.456245461217E-02 0.25467E-01 -0.77356E-03 21225 0.727E-02 0.211E-01
RMM: 3 -0.593827456428E-02 -0.13758E-02 -0.65877E-04 22869 0.186E-02 0.128E-01
RMM: 4 -0.662006209368E-02 -0.68179E-03 -0.78629E-04 23074 0.218E-02 0.210E-02
RMM: 5 -0.690593416235E-02 -0.28587E-03 -0.36583E-05 23048 0.544E-03 0.123E-02
RMM: 6 -0.699554628749E-02 -0.89612E-04 0.36070E-06 23254 0.304E-03 0.551E-03
RMM: 7 -0.692970781135E-02 0.65838E-04 0.11249E-05 23904 0.140E-03 0.289E-03
RMM: 8 -0.685734073394E-02 0.72367E-04 0.85384E-06 24321 0.102E-03 0.128E-03
RMM: 9 -0.682626249633E-02 0.31078E-04 0.73687E-06 25648 0.582E-04 0.627E-04
RMM: 10 -0.682419470740E-02 0.20678E-05 0.70985E-06 28056 0.351E-04 0.323E-04
Linear response progress:
Degree of freedom: 11/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.102194087401E-01 -0.10219E-01 -0.14118E-02 35089 0.156E-01
RMM: 2 -0.102100178758E-02 0.91984E-02 -0.40764E-03 21848 0.496E-02 0.129E-01
RMM: 3 -0.378076101352E-02 -0.27598E-02 -0.35280E-04 22783 0.139E-02 0.790E-02
RMM: 4 -0.611734820334E-02 -0.23366E-02 -0.51706E-04 22963 0.167E-02 0.189E-02
RMM: 5 -0.647614247250E-02 -0.35879E-03 -0.80338E-05 23006 0.513E-03 0.857E-03
RMM: 6 -0.648097960772E-02 -0.48371E-05 -0.27690E-05 23237 0.197E-03 0.442E-03
Linear response progress:
Degree of freedom: 12/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.201307518117E-01 -0.20131E-01 -0.59612E-02 37063 0.200E-01
RMM: 2 -0.282577195612E-02 0.17305E-01 -0.40478E-03 21448 0.634E-02 0.180E-01
RMM: 3 -0.513769096314E-02 -0.23119E-02 0.85747E-05 22815 0.171E-02 0.112E-01
RMM: 4 -0.694941105435E-02 -0.18117E-02 0.95493E-04 23041 0.204E-02 0.218E-02
RMM: 5 -0.727904931373E-02 -0.32964E-03 0.19888E-03 23099 0.544E-03 0.104E-02
RMM: 6 -0.734952818588E-02 -0.70479E-04 0.23485E-03 23480 0.253E-03 0.508E-03
RMM: 7 -0.731374860642E-02 0.35780E-04 0.25681E-03 23905 0.126E-03 0.252E-03
RMM: 8 -0.727739535767E-02 0.36353E-04 0.27513E-03 24386 0.934E-04 0.118E-03
RMM: 9 -0.726259995228E-02 0.14795E-04 0.28176E-03 25612 0.596E-04 0.595E-04
RMM: 10 -0.726811999387E-02 -0.55200E-05 0.27720E-03 27936 0.373E-04 0.231E-04
RMM: 11 -0.727299557476E-02 -0.48756E-05 0.27244E-03 30198 0.304E-04 0.113E-04
RMM: 12 -0.727580511194E-02 -0.28095E-05 0.27016E-03 31782 0.279E-04 0.478E-05
RMM: 13 -0.727690835593E-02 -0.11032E-05 0.26911E-03 32684 0.270E-04 0.219E-05
RMM: 14 -0.727738253078E-02 -0.47417E-06 0.26847E-03 32747 0.268E-04 0.110E-05
Linear response progress:
Degree of freedom: 13/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.270650985257E-01 -0.27065E-01 -0.91498E-02 36799 0.219E-01
RMM: 2 -0.331475985233E-02 0.23750E-01 -0.73598E-03 21522 0.715E-02 0.211E-01
RMM: 3 -0.506428405091E-02 -0.17495E-02 -0.67096E-04 22872 0.188E-02 0.128E-01
RMM: 4 -0.586834781177E-02 -0.80406E-03 -0.90004E-04 23075 0.211E-02 0.216E-02
RMM: 5 -0.617046779768E-02 -0.30212E-03 -0.25299E-04 23072 0.634E-03 0.109E-02
RMM: 6 -0.615697290225E-02 0.13495E-04 -0.20807E-04 23506 0.239E-03 0.577E-03
RMM: 7 -0.611473175399E-02 0.42241E-04 -0.23656E-04 23663 0.153E-03 0.281E-03
RMM: 8 -0.602473821499E-02 0.89994E-04 -0.24442E-04 24366 0.109E-03 0.107E-03
RMM: 9 -0.600876577993E-02 0.15972E-04 -0.23355E-04 26039 0.539E-04 0.670E-04
RMM: 10 -0.600069771798E-02 0.80681E-05 -0.23945E-04 27125 0.404E-04 0.278E-04
RMM: 11 -0.600165584977E-02 -0.95813E-06 -0.24031E-04 29963 0.294E-04 0.106E-04
RMM: 12 -0.600305830169E-02 -0.14025E-05 -0.24359E-04 32013 0.261E-04 0.549E-05
RMM: 13 -0.600300181680E-02 0.56485E-07 -0.24340E-04 32489 0.254E-04 0.241E-05
RMM: 14 -0.600304231236E-02 -0.40496E-07 -0.24599E-04 32761 0.251E-04 0.113E-05
Linear response progress:
Degree of freedom: 14/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.114552637732E-01 -0.11455E-01 -0.20039E-02 36248 0.168E-01
RMM: 2 -0.127075725410E-02 0.10185E-01 -0.34664E-03 21860 0.511E-02 0.145E-01
RMM: 3 -0.426558417972E-02 -0.29948E-02 -0.36846E-04 22734 0.141E-02 0.888E-02
RMM: 4 -0.629910135333E-02 -0.20335E-02 -0.49831E-04 22981 0.161E-02 0.185E-02
RMM: 5 -0.640613905869E-02 -0.10704E-03 -0.92664E-05 23055 0.461E-03 0.715E-03
RMM: 6 -0.634312274563E-02 0.63016E-04 -0.74241E-05 23546 0.162E-03 0.387E-03
RMM: 7 -0.625500160149E-02 0.88121E-04 -0.88931E-05 23484 0.118E-03 0.166E-03
RMM: 8 -0.622837615202E-02 0.26625E-04 -0.97029E-05 24739 0.537E-04 0.910E-04
RMM: 9 -0.622187534767E-02 0.65008E-05 -0.93179E-05 25105 0.435E-04 0.464E-04
Linear response progress:
Degree of freedom: 15/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.250253331516E-01 -0.25025E-01 -0.80123E-02 36444 0.217E-01
RMM: 2 -0.276066598041E-02 0.22265E-01 -0.67999E-03 21571 0.700E-02 0.215E-01
RMM: 3 -0.484607545702E-02 -0.20854E-02 -0.65927E-04 22761 0.188E-02 0.131E-01
RMM: 4 -0.598523274362E-02 -0.11392E-02 -0.65259E-04 23064 0.214E-02 0.218E-02
RMM: 5 -0.625112789923E-02 -0.26590E-03 0.62047E-05 23119 0.657E-03 0.115E-02
RMM: 6 -0.624544128488E-02 0.56866E-05 0.14857E-04 23603 0.229E-03 0.607E-03
RMM: 7 -0.619717796050E-02 0.48263E-04 0.14701E-04 23497 0.178E-03 0.278E-03
RMM: 8 -0.613549129858E-02 0.61687E-04 0.14044E-04 24453 0.978E-04 0.883E-04
RMM: 9 -0.612090222199E-02 0.14589E-04 0.14294E-04 26331 0.494E-04 0.612E-04
RMM: 10 -0.611859839847E-02 0.23038E-05 0.14156E-04 27239 0.388E-04 0.183E-04
RMM: 11 -0.611976246288E-02 -0.11641E-05 0.14246E-04 30788 0.287E-04 0.959E-05
RMM: 12 -0.612089158306E-02 -0.11291E-05 0.13872E-04 32368 0.264E-04 0.440E-05
RMM: 13 -0.612172203162E-02 -0.83045E-06 0.13649E-04 32847 0.259E-04 0.245E-05
RMM: 14 -0.612228556883E-02 -0.56354E-06 0.12951E-04 33060 0.257E-04 0.115E-05
Linear response progress:
Degree of freedom: 16/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.983834416087E-02 -0.98383E-02 -0.24525E-02 34987 0.154E-01
RMM: 2 -0.970150419086E-04 0.97413E-02 -0.29299E-03 22117 0.436E-02 0.134E-01
RMM: 3 -0.359753849158E-02 -0.35005E-02 -0.29632E-04 22536 0.126E-02 0.832E-02
RMM: 4 -0.621742495055E-02 -0.26199E-02 -0.18218E-04 22627 0.147E-02 0.164E-02
RMM: 5 -0.629371149206E-02 -0.76287E-04 0.26454E-04 22813 0.372E-03 0.679E-03
RMM: 6 -0.622371707545E-02 0.69994E-04 0.40345E-04 23039 0.143E-03 0.360E-03
RMM: 7 -0.612504280377E-02 0.98674E-04 0.51139E-04 23233 0.992E-04 0.157E-03
RMM: 8 -0.608652908263E-02 0.38514E-04 0.57710E-04 24123 0.534E-04 0.779E-04
RMM: 9 -0.607999787071E-02 0.65312E-05 0.63913E-04 25000 0.344E-04 0.394E-04
RMM: 10 -0.608198756332E-02 -0.19897E-05 0.65735E-04 26981 0.203E-04 0.155E-04
RMM: 11 -0.608115331164E-02 0.83425E-06 0.67013E-04 29891 0.146E-04 0.895E-05
RMM: 12 -0.608071709537E-02 0.43622E-06 0.66910E-04 30491 0.137E-04 0.395E-05
RMM: 13 -0.608225779681E-02 -0.15407E-05 0.65508E-04 31415 0.129E-04 0.195E-05
RMM: 14 -0.608119899722E-02 0.10588E-05 0.66693E-04 31269 0.127E-04 0.892E-06
Linear response progress:
Degree of freedom: 17/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.331890932044E-01 -0.33189E-01 -0.10640E-01 36906 0.242E-01
RMM: 2 -0.529039423266E-02 0.27899E-01 -0.90458E-03 21185 0.772E-02 0.234E-01
RMM: 3 -0.657156739541E-02 -0.12812E-02 -0.72865E-04 22651 0.202E-02 0.139E-01
RMM: 4 -0.699683443329E-02 -0.42527E-03 -0.75370E-04 23018 0.215E-02 0.210E-02
RMM: 5 -0.735246594950E-02 -0.35563E-03 -0.58043E-05 23041 0.612E-03 0.113E-02
RMM: 6 -0.733396678428E-02 0.18499E-04 0.48353E-06 23444 0.268E-03 0.593E-03
RMM: 7 -0.733172464963E-02 0.22421E-05 0.20288E-05 23434 0.174E-03 0.296E-03
Linear response progress:
Degree of freedom: 18/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.230791189656E-01 -0.23079E-01 -0.75581E-02 37273 0.207E-01
RMM: 2 -0.343076444598E-02 0.19648E-01 -0.60580E-03 21483 0.670E-02 0.195E-01
RMM: 3 -0.534805355170E-02 -0.19173E-02 -0.47831E-04 22637 0.181E-02 0.120E-01
RMM: 4 -0.639153843713E-02 -0.10435E-02 -0.18846E-04 22911 0.198E-02 0.225E-02
RMM: 5 -0.670776544236E-02 -0.31623E-03 0.68380E-04 22996 0.585E-03 0.963E-03
RMM: 6 -0.664880582474E-02 0.58960E-04 0.88962E-04 23429 0.252E-03 0.533E-03
RMM: 7 -0.662887864669E-02 0.19927E-04 0.11126E-03 23573 0.131E-03 0.245E-03
RMM: 8 -0.655697017581E-02 0.71908E-04 0.12769E-03 24287 0.942E-04 0.105E-03
RMM: 9 -0.653246140585E-02 0.24509E-04 0.13822E-03 25605 0.552E-04 0.603E-04
RMM: 10 -0.652122794999E-02 0.11233E-04 0.14426E-03 27321 0.366E-04 0.225E-04
RMM: 11 -0.651983584529E-02 0.13921E-05 0.14698E-03 30610 0.274E-04 0.114E-04
RMM: 12 -0.651916368897E-02 0.67216E-06 0.14907E-03 31946 0.253E-04 0.454E-05
RMM: 13 -0.651803137588E-02 0.11323E-05 0.15046E-03 32959 0.244E-04 0.250E-05
RMM: 14 -0.651678195882E-02 0.12494E-05 0.15155E-03 33011 0.242E-04 0.128E-05
Linear response progress:
Degree of freedom: 19/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.274367183245E-01 -0.27437E-01 -0.63000E-02 36867 0.237E-01
RMM: 2 -0.411628034904E-02 0.23320E-01 -0.76339E-03 21860 0.768E-02 0.208E-01
RMM: 3 -0.641405534360E-02 -0.22978E-02 -0.68148E-04 22900 0.199E-02 0.125E-01
RMM: 4 -0.826137408779E-02 -0.18473E-02 -0.93524E-04 23093 0.231E-02 0.209E-02
RMM: 5 -0.877786031033E-02 -0.51649E-03 -0.85044E-05 23143 0.615E-03 0.117E-02
RMM: 6 -0.891937486956E-02 -0.14151E-03 -0.28400E-05 23420 0.301E-03 0.561E-03
RMM: 7 -0.892408530491E-02 -0.47104E-05 -0.14060E-05 23768 0.156E-03 0.316E-03
Linear response progress:
Degree of freedom: 20/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.250862733028E-01 -0.25086E-01 -0.50359E-02 37039 0.232E-01
RMM: 2 -0.341675556237E-02 0.21670E-01 -0.77091E-03 21899 0.753E-02 0.207E-01
RMM: 3 -0.579348790620E-02 -0.23767E-02 -0.73689E-04 22934 0.200E-02 0.124E-01
RMM: 4 -0.771852311335E-02 -0.19250E-02 -0.84131E-04 23110 0.229E-02 0.212E-02
RMM: 5 -0.816861966198E-02 -0.45010E-03 -0.38843E-05 23154 0.558E-03 0.126E-02
RMM: 6 -0.837966445417E-02 -0.21104E-03 0.42492E-05 23339 0.318E-03 0.571E-03
RMM: 7 -0.842286576510E-02 -0.43201E-04 0.80131E-05 23845 0.162E-03 0.321E-03
RMM: 8 -0.833785062828E-02 0.85015E-04 0.12527E-04 24300 0.134E-03 0.115E-03
RMM: 9 -0.832983020842E-02 0.80204E-05 0.14295E-04 26189 0.610E-04 0.649E-04
RMM: 10 -0.831746147863E-02 0.12369E-04 0.15987E-04 27904 0.430E-04 0.228E-04
RMM: 11 -0.831702221585E-02 0.43926E-06 0.17062E-04 31129 0.338E-04 0.113E-04
RMM: 12 -0.831746562764E-02 -0.44341E-06 0.17607E-04 32984 0.308E-04 0.477E-05
RMM: 13 -0.831764907238E-02 -0.18344E-06 0.18412E-04 33425 0.303E-04 0.227E-05
RMM: 14 -0.831749272743E-02 0.15634E-06 0.18335E-04 33614 0.300E-04 0.118E-05
Linear response progress:
Degree of freedom: 21/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.329855517505E-01 -0.32986E-01 -0.74435E-02 37268 0.257E-01
RMM: 2 -0.641041252685E-02 0.26575E-01 -0.84778E-03 22053 0.821E-02 0.221E-01
RMM: 3 -0.828314637618E-02 -0.18727E-02 -0.64393E-04 23028 0.206E-02 0.132E-01
RMM: 4 -0.955942505486E-02 -0.12763E-02 -0.32068E-04 23167 0.239E-02 0.220E-02
RMM: 5 -0.993907634387E-02 -0.37965E-03 0.96925E-04 23183 0.652E-03 0.124E-02
RMM: 6 -0.100107169518E-01 -0.71641E-04 0.13046E-03 23428 0.323E-03 0.591E-03
RMM: 7 -0.996378932219E-02 0.46928E-04 0.15484E-03 23940 0.165E-03 0.331E-03
RMM: 8 -0.985745621843E-02 0.10633E-03 0.17819E-03 24310 0.132E-03 0.112E-03
RMM: 9 -0.983903095675E-02 0.18425E-04 0.18618E-03 26574 0.588E-04 0.649E-04
RMM: 10 -0.983258404616E-02 0.64469E-05 0.19084E-03 28058 0.438E-04 0.211E-04
RMM: 11 -0.983023445549E-02 0.23496E-05 0.19546E-03 31312 0.341E-04 0.115E-04
RMM: 12 -0.983005889181E-02 0.17556E-06 0.19720E-03 32503 0.319E-04 0.522E-05
RMM: 13 -0.982861463473E-02 0.14443E-05 0.19935E-03 33137 0.312E-04 0.233E-05
Linear response progress:
Degree of freedom: 22/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.182451400373E-01 -0.18245E-01 -0.44217E-02 36833 0.195E-01
RMM: 2 -0.297558933030E-02 0.15270E-01 -0.48229E-03 21422 0.631E-02 0.165E-01
RMM: 3 -0.499480975274E-02 -0.20192E-02 -0.45481E-04 22989 0.163E-02 0.103E-01
RMM: 4 -0.646946856310E-02 -0.14747E-02 -0.63036E-04 23093 0.195E-02 0.202E-02
RMM: 5 -0.671383238202E-02 -0.24436E-03 0.23772E-05 23089 0.510E-03 0.104E-02
RMM: 6 -0.675394589760E-02 -0.40114E-04 0.87709E-05 23329 0.252E-03 0.489E-03
RMM: 7 -0.668476128205E-02 0.69185E-04 0.13528E-04 23861 0.133E-03 0.224E-03
RMM: 8 -0.664145343756E-02 0.43308E-04 0.18420E-04 24726 0.739E-04 0.110E-03
RMM: 9 -0.662426862376E-02 0.17185E-04 0.16500E-04 25682 0.511E-04 0.535E-04
RMM: 10 -0.662602808264E-02 -0.17595E-05 0.15986E-04 27706 0.332E-04 0.176E-04
RMM: 11 -0.662647708908E-02 -0.44901E-06 0.15333E-04 30879 0.257E-04 0.100E-04
RMM: 12 -0.662899600978E-02 -0.25189E-05 0.13928E-04 31964 0.240E-04 0.373E-05
RMM: 13 -0.662686071980E-02 0.21353E-05 0.16415E-04 32573 0.232E-04 0.196E-05
RMM: 14 -0.662905347471E-02 -0.21928E-05 0.14237E-04 32564 0.231E-04 0.109E-05
Linear response progress:
Degree of freedom: 23/***
N E dE d eps ncg rms rms(c)
RMM: 1 -0.244511986042E-01 -0.24451E-01 -0.89666E-02 36682 0.213E-01
RMM: 2 -0.252325162500E-02 0.21928E-01 -0.64191E-03 21206 0.687E-02 0.193E-01
RMM: 3 -0.475076370375E-02 -0.22275E-02 -0.51546E-04 22694 0.179E-02 0.117E-01
RMM: 4 -0.651631734094E-02 -0.17656E-02 -0.53317E-04 22913 0.203E-02 0.205E-02
RMM: 5 -0.691399957886E-02 -0.39768E-03 0.13123E-04 23020 0.577E-03 0.106E-02
RMM: 6 -0.694892969955E-02 -0.34930E-04 0.22138E-04 23434 0.234E-03 0.553E-03
RMM: 7 -0.693728742949E-02 0.11642E-04 0.27366E-04 23528 0.148E-03 0.274E-03
RMM: 8 -0.689119348229E-02 0.46094E-04 0.32387E-04 24375 0.975E-04 0.107E-03
RMM: 9 -0.687748028446E-02 0.13713E-04 0.34732E-04 25806 0.539E-04 0.631E-04
RMM: 10 -0.687197736382E-02 0.55029E-05 0.36928E-04 27252 0.377E-04 0.253E-04
RMM: 11 -0.687233364800E-02 -0.35628E-06 0.37920E-04 30426 0.281E-04 0.109E-04
RMM: 12 -0.687242899151E-02 -0.95344E-07 0.38814E-04 32254 0.253E-04 0.500E-05