N E dE d eps ncg rms rms(c) DAV: 1 0.420839376382E+03 0.42084E+03 -0.39981E+04 2048 0.117E+03 DAV: 2 -0.234291491672E+02 -0.44427E+03 -0.44364E+03 3072 0.170E+02 DAV: 3 -0.352833808471E+02 -0.11854E+02 -0.11854E+02 2048 0.409E+01 DAV: 4 -0.353922717810E+02 -0.10889E+00 -0.10889E+00 4096 0.509E+00 DAV: 5 -0.353922884651E+02 -0.16684E-04 -0.16684E-04 2112 0.637E-02 0.926E+00 DAV: 6 -0.340395211624E+02 0.13528E+01 -0.50940E+00 3456 0.118E+01 0.598E+00 DAV: 7 -0.339200774159E+02 0.11944E+00 -0.52715E-01 3648 0.438E+00 0.313E+00 DAV: 8 -0.339132250821E+02 0.68523E-02 -0.79592E-02 3840 0.136E+00 0.369E-01 DAV: 9 -0.339145490253E+02 -0.13239E-02 -0.53002E-03 2752 0.362E-01 0.140E-01 DAV: 10 -0.339151815181E+02 -0.63249E-03 -0.10719E-03 3776 0.120E-01 0.769E-02 DAV: 11 -0.339152437066E+02 -0.62189E-04 -0.10655E-04 3328 0.508E-02 0.225E-02 DAV: 12 -0.339152680791E+02 -0.24372E-04 -0.29439E-05 3136 0.249E-02 0.657E-03 DAV: 13 -0.339152691415E+02 -0.10624E-05 -0.23197E-06 3392 0.555E-03 1 F= -.33915269E+02 E0= -.33915269E+02 d E =-.339153E+02 N E dE d eps ncg rms rms(c) DAV: 1 -0.364041127408E+02 -0.24888E+01 -0.54398E+01 2048 0.410E+01 0.101E+01 DAV: 2 -0.343500256437E+02 0.20541E+01 -0.62194E+00 2624 0.136E+01 0.302E+00 DAV: 3 -0.340886573179E+02 0.26137E+00 -0.77712E-01 2304 0.545E+00 0.165E+00 DAV: 4 -0.340670566838E+02 0.21601E-01 -0.49564E-02 3456 0.151E+00 0.997E-01 DAV: 5 -0.340643555623E+02 0.27011E-02 -0.10704E-02 3392 0.666E-01 0.138E-01 DAV: 6 -0.340643556886E+02 -0.12626E-06 -0.74330E-04 2880 0.121E-01 0.676E-02 DAV: 7 -0.340643854171E+02 -0.29729E-04 -0.56160E-05 3520 0.472E-02 0.185E-02 DAV: 8 -0.340643853420E+02 0.75113E-07 -0.99522E-06 3008 0.196E-02 2 F= -.34064385E+02 E0= -.34064385E+02 d E =-.149116E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.341654518816E+02 -0.10107E+00 -0.22819E+00 2304 0.867E+00 0.199E+00 DAV: 2 -0.340814960113E+02 0.83956E-01 -0.23031E-01 2752 0.291E+00 0.642E-01 DAV: 3 -0.340701998688E+02 0.11296E-01 -0.33799E-02 2368 0.112E+00 0.363E-01 DAV: 4 -0.340693497695E+02 0.85010E-03 -0.20076E-03 3456 0.323E-01 0.175E-01 DAV: 5 -0.340693044150E+02 0.45355E-04 -0.33317E-04 3200 0.123E-01 0.270E-02 DAV: 6 -0.340693092373E+02 -0.48223E-05 -0.23452E-05 3200 0.257E-02 3 F= -.34069309E+02 E0= -.34069309E+02 d E =-.154040E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.341123860074E+02 -0.43082E-01 -0.33788E+00 2048 0.649E+00 0.113E+00 DAV: 2 -0.340939024325E+02 0.18484E-01 -0.13392E-01 3328 0.200E+00 0.460E-01 DAV: 3 -0.340903599306E+02 0.35425E-02 -0.10282E-02 3264 0.639E-01 0.249E-01 DAV: 4 -0.340900050264E+02 0.35490E-03 -0.12794E-03 3072 0.224E-01 0.126E-01 DAV: 5 -0.340900112574E+02 -0.62310E-05 -0.12607E-04 3008 0.567E-02 0.121E-02 DAV: 6 -0.340900108716E+02 0.38574E-06 -0.10057E-05 3008 0.149E-02 4 F= -.34090011E+02 E0= -.34090011E+02 d E =-.207016E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.341642686637E+02 -0.74257E-01 -0.97307E+00 2048 0.110E+01 0.194E+00 DAV: 2 -0.341102925677E+02 0.53976E-01 -0.39203E-01 3328 0.341E+00 0.816E-01 DAV: 3 -0.341000948668E+02 0.10198E-01 -0.29459E-02 3264 0.110E+00 0.431E-01 DAV: 4 -0.340990088678E+02 0.10860E-02 -0.39669E-03 3072 0.394E-01 0.222E-01 DAV: 5 -0.340989934694E+02 0.15398E-04 -0.37204E-04 3008 0.898E-02 0.210E-02 DAV: 6 -0.340989911717E+02 0.22978E-05 -0.30700E-05 3648 0.243E-02 5 F= -.34098991E+02 E0= -.34098991E+02 d E =-.296819E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.341033153655E+02 -0.43219E-02 -0.51703E-01 2048 0.257E+00 0.448E-01 DAV: 2 -0.341005544959E+02 0.27609E-02 -0.20599E-02 3200 0.788E-01 0.196E-01 DAV: 3 -0.340999985997E+02 0.55590E-03 -0.15507E-03 3328 0.247E-01 0.106E-01 DAV: 4 -0.340999233059E+02 0.75294E-04 -0.22522E-04 3136 0.947E-02 0.506E-02 DAV: 5 -0.340999090342E+02 0.14272E-04 -0.19526E-05 2944 0.214E-02 0.462E-03 DAV: 6 -0.340999090450E+02 -0.10786E-07 -0.17291E-06 2560 0.655E-03 6 F= -.34099909E+02 E0= -.34099909E+02 d E =-.305998E-01