N E dE d eps ncg rms rms(c)
DAV: 1 0.197202295693E+04 0.19720E+04 -0.16352E+05 3840 0.117E+03
DAV: 2 -0.502024358719E+03 -0.24740E+04 -0.23961E+04 4688 0.293E+02
DAV: 3 -0.702356793969E+03 -0.20033E+03 -0.19892E+03 4512 0.894E+01
DAV: 4 -0.706525284843E+03 -0.41685E+01 -0.41514E+01 4616 0.135E+01
DAV: 5 -0.706638352363E+03 -0.11307E+00 -0.11291E+00 4568 0.207E+00 0.645E+01
DAV: 6 -0.626500290757E+03 0.80138E+02 -0.32288E+02 4352 0.327E+01 0.308E+01
DAV: 7 -0.624778049630E+03 0.17222E+01 -0.14354E+01 4808 0.763E+00 0.135E+01
DAV: 8 -0.624284423772E+03 0.49363E+00 -0.20845E+00 4512 0.361E+00 0.545E+00
DAV: 9 -0.624247755568E+03 0.36668E-01 -0.42220E-01 4616 0.167E+00 0.104E+00
DAV: 10 -0.624262634930E+03 -0.14879E-01 -0.59488E-02 4456 0.632E-01 0.641E-01
DAV: 11 -0.624269635667E+03 -0.70007E-02 -0.18727E-02 4480 0.378E-01 0.301E-01
DAV: 12 -0.624272184959E+03 -0.25493E-02 -0.38362E-03 4448 0.182E-01 0.132E-01
DAV: 13 -0.624273006865E+03 -0.82191E-03 -0.18612E-03 4656 0.128E-01 0.448E-02
DAV: 14 -0.624273099317E+03 -0.92452E-04 -0.32992E-04 4600 0.477E-02 0.302E-02
DAV: 15 -0.624273124234E+03 -0.24917E-04 -0.79374E-05 4200 0.220E-02 0.135E-02
DAV: 16 -0.624273130097E+03 -0.58626E-05 -0.16904E-05 2984 0.139E-02
1 F= -.62427313E+03 E0= -.62425461E+03 d E =-.624273E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.607497094020E+03 0.16776E+02 -0.21156E+03 4040 0.896E+01 0.221E+01
DAV: 2 -0.623228802357E+03 -0.15732E+02 -0.17555E+02 4504 0.209E+01 0.119E+01
DAV: 3 -0.620798135697E+03 0.24307E+01 -0.85203E+00 4744 0.813E+00 0.732E+00
DAV: 4 -0.620310222191E+03 0.48791E+00 -0.71627E+00 4432 0.660E+00 0.383E+00
DAV: 5 -0.620246345995E+03 0.63876E-01 -0.11366E+00 4680 0.242E+00 0.244E+00
DAV: 6 -0.620171953367E+03 0.74393E-01 -0.26458E-01 4488 0.162E+00 0.933E-01
DAV: 7 -0.620167481426E+03 0.44719E-02 -0.15862E-01 4528 0.907E-01 0.515E-01
DAV: 8 -0.620166884176E+03 0.59725E-03 -0.28575E-02 4480 0.376E-01 0.237E-01
DAV: 9 -0.620165720718E+03 0.11635E-02 -0.51219E-03 4616 0.233E-01 0.103E-01
DAV: 10 -0.620165619733E+03 0.10099E-03 -0.20315E-03 4648 0.146E-01 0.539E-02
DAV: 11 -0.620165680608E+03 -0.60876E-04 -0.93795E-04 4480 0.726E-02 0.500E-02
DAV: 12 -0.620165673929E+03 0.66796E-05 -0.52445E-05 4336 0.173E-02
2 F= -.62016567E+03 E0= -.62014718E+03 d E =0.410746E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.623034407586E+03 -0.28687E+01 -0.30222E+02 3840 0.300E+01 0.577E+00
DAV: 2 -0.624126348214E+03 -0.10919E+01 -0.15551E+01 4512 0.583E+00 0.398E+00
DAV: 3 -0.623959819791E+03 0.16653E+00 -0.57745E-01 4512 0.168E+00 0.264E+00
DAV: 4 -0.623902424962E+03 0.57395E-01 -0.39010E-01 4288 0.120E+00 0.113E+00
DAV: 5 -0.623891771732E+03 0.10653E-01 -0.41938E-02 5048 0.730E-01 0.524E-01
DAV: 6 -0.623891169612E+03 0.60212E-03 -0.18935E-02 4432 0.339E-01 0.229E-01
DAV: 7 -0.623890838822E+03 0.33079E-03 -0.30851E-03 4496 0.147E-01 0.123E-01
DAV: 8 -0.623890767416E+03 0.71405E-04 -0.89452E-04 4472 0.710E-02 0.528E-02
DAV: 9 -0.623890748555E+03 0.18861E-04 -0.12538E-04 5120 0.406E-02 0.373E-02
DAV: 10 -0.623890735476E+03 0.13079E-04 -0.12557E-04 4792 0.343E-02 0.154E-02
DAV: 11 -0.623890734578E+03 0.89802E-06 -0.27133E-05 3576 0.144E-02
3 F= -.62389073E+03 E0= -.62387217E+03 d E =0.382396E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.625332822166E+03 -0.14421E+01 -0.10047E+02 3840 0.191E+01 0.352E+00
DAV: 2 -0.625545574412E+03 -0.21275E+00 -0.34833E+00 4480 0.336E+00 0.186E+00
DAV: 3 -0.625511149930E+03 0.34424E-01 -0.13074E-01 4488 0.865E-01 0.125E+00
DAV: 4 -0.625493060189E+03 0.18090E-01 -0.15102E-01 4400 0.898E-01 0.500E-01
DAV: 5 -0.625489233021E+03 0.38272E-02 -0.24019E-02 5168 0.456E-01 0.284E-01
DAV: 6 -0.625488951272E+03 0.28175E-03 -0.10114E-02 4376 0.259E-01 0.151E-01
DAV: 7 -0.625488829246E+03 0.12203E-03 -0.79123E-04 4664 0.958E-02 0.837E-02
DAV: 8 -0.625488764502E+03 0.64744E-04 -0.48744E-04 4760 0.703E-02 0.402E-02
DAV: 9 -0.625488745699E+03 0.18804E-04 -0.11497E-04 4736 0.340E-02 0.237E-02
DAV: 10 -0.625488741180E+03 0.45183E-05 -0.53570E-05 4408 0.190E-02
4 F= -.62548874E+03 E0= -.62547017E+03 d E =-.121561E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.626171422615E+03 -0.68268E+00 -0.18038E+02 3840 0.273E+01 0.588E+00
DAV: 2 -0.626690762917E+03 -0.51934E+00 -0.72777E+00 4496 0.515E+00 0.266E+00
DAV: 3 -0.626621986486E+03 0.68776E-01 -0.24059E-01 4584 0.119E+00 0.186E+00
DAV: 4 -0.626581074340E+03 0.40912E-01 -0.23097E-01 4408 0.115E+00 0.721E-01
DAV: 5 -0.626573364650E+03 0.77097E-02 -0.29556E-02 5208 0.598E-01 0.388E-01
DAV: 6 -0.626572296886E+03 0.10678E-02 -0.23258E-02 5136 0.440E-01 0.171E-01
DAV: 7 -0.626572230533E+03 0.66353E-04 -0.44501E-03 4704 0.174E-01 0.136E-01
DAV: 8 -0.626572038140E+03 0.19239E-03 -0.11880E-03 4520 0.920E-02 0.575E-02
DAV: 9 -0.626571990992E+03 0.47149E-04 -0.15748E-04 4656 0.495E-02 0.274E-02
DAV: 10 -0.626571987783E+03 0.32085E-05 -0.12368E-04 5064 0.333E-02 0.135E-02
DAV: 11 -0.626571987328E+03 0.45526E-06 -0.18959E-05 2920 0.135E-02
5 F= -.62657199E+03 E0= -.62655342E+03 d E =-.229886E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.626120606387E+03 0.45138E+00 -0.29577E+02 3840 0.389E+01 0.583E+00
DAV: 2 -0.626855478095E+03 -0.73487E+00 -0.10210E+01 4528 0.624E+00 0.316E+00
DAV: 3 -0.626690594358E+03 0.16488E+00 -0.37345E-01 4512 0.182E+00 0.186E+00
DAV: 4 -0.626648137640E+03 0.42457E-01 -0.34487E-01 4424 0.158E+00 0.693E-01
DAV: 5 -0.626645491225E+03 0.26464E-02 -0.64582E-02 5000 0.717E-01 0.512E-01
DAV: 6 -0.626645586788E+03 -0.95563E-04 -0.18481E-02 4416 0.330E-01 0.257E-01
DAV: 7 -0.626645120175E+03 0.46661E-03 -0.17447E-03 4688 0.131E-01 0.177E-01
DAV: 8 -0.626645041854E+03 0.78322E-04 -0.17806E-03 4496 0.116E-01 0.909E-02
DAV: 9 -0.626644949036E+03 0.92818E-04 -0.32003E-04 5592 0.591E-02 0.426E-02
DAV: 10 -0.626644939092E+03 0.99434E-05 -0.19967E-04 4592 0.362E-02 0.149E-02
DAV: 11 -0.626644939416E+03 -0.32378E-06 -0.19879E-05 3504 0.149E-02
6 F= -.62664494E+03 E0= -.62662644E+03 d E =-.729521E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.627036955627E+03 -0.39202E+00 -0.72221E+01 3840 0.190E+01 0.297E+00
DAV: 2 -0.627187379838E+03 -0.15042E+00 -0.22832E+00 4528 0.307E+00 0.148E+00
DAV: 3 -0.627150610483E+03 0.36769E-01 -0.92008E-02 4512 0.889E-01 0.889E-01
DAV: 4 -0.627140965445E+03 0.96450E-02 -0.77332E-02 4424 0.709E-01 0.367E-01
DAV: 5 -0.627140004396E+03 0.96105E-03 -0.12223E-02 5112 0.335E-01 0.244E-01
DAV: 6 -0.627140150125E+03 -0.14573E-03 -0.50680E-03 4448 0.186E-01 0.123E-01
DAV: 7 -0.627140005905E+03 0.14422E-03 -0.69436E-04 4760 0.787E-02 0.834E-02
DAV: 8 -0.627139982304E+03 0.23602E-04 -0.51528E-04 4504 0.568E-02 0.383E-02
DAV: 9 -0.627139965806E+03 0.16497E-04 -0.54822E-05 4632 0.272E-02 0.179E-02
DAV: 10 -0.627139964249E+03 0.15572E-05 -0.42880E-05 4192 0.176E-02
7 F= -.62713996E+03 E0= -.62712142E+03 d E =-.567977E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.627297212086E+03 -0.15725E+00 -0.12198E+02 3840 0.252E+01 0.349E+00
DAV: 2 -0.627571468235E+03 -0.27426E+00 -0.32530E+00 4496 0.362E+00 0.143E+00
DAV: 3 -0.627536686821E+03 0.34781E-01 -0.72273E-02 4608 0.781E-01 0.820E-01
DAV: 4 -0.627526167145E+03 0.10520E-01 -0.59817E-02 4448 0.632E-01 0.247E-01
DAV: 5 -0.627526299845E+03 -0.13270E-03 -0.11772E-02 4632 0.307E-01 0.182E-01
DAV: 6 -0.627526477609E+03 -0.17776E-03 -0.26762E-03 4456 0.125E-01 0.982E-02
DAV: 7 -0.627526407360E+03 0.70249E-04 -0.27920E-04 4480 0.500E-02 0.721E-02
DAV: 8 -0.627526402536E+03 0.48240E-05 -0.24570E-04 4600 0.400E-02 0.343E-02
DAV: 9 -0.627526387166E+03 0.15370E-04 -0.55511E-05 4648 0.274E-02 0.139E-02
DAV: 10 -0.627526387857E+03 -0.69099E-06 -0.37823E-05 3576 0.153E-02
8 F= -.62752639E+03 E0= -.62750782E+03 d E =-.386424E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.627526573746E+03 -0.18658E-03 -0.10916E-01 3968 0.758E-01 0.106E-01
DAV: 2 -0.627526807822E+03 -0.23408E-03 -0.28376E-03 4496 0.107E-01 0.423E-02
DAV: 3 -0.627526778016E+03 0.29806E-04 -0.57977E-05 4544 0.218E-02 0.245E-02
DAV: 4 -0.627526769234E+03 0.87815E-05 -0.53897E-05 4336 0.194E-02
9 F= -.62752677E+03 E0= -.62750820E+03 d E =-.386805E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.627675413300E+03 -0.14864E+00 -0.91661E+01 3840 0.220E+01 0.247E+00
DAV: 2 -0.627861314842E+03 -0.18590E+00 -0.22034E+00 4456 0.299E+00 0.119E+00
DAV: 3 -0.627840875872E+03 0.20439E-01 -0.44078E-02 4608 0.626E-01 0.726E-01
DAV: 4 -0.627833513215E+03 0.73627E-02 -0.43048E-02 4464 0.600E-01 0.216E-01
DAV: 5 -0.627833748787E+03 -0.23557E-03 -0.96375E-03 4464 0.259E-01 0.173E-01
DAV: 6 -0.627833802291E+03 -0.53503E-04 -0.29759E-03 4456 0.134E-01 0.877E-02
DAV: 7 -0.627833750600E+03 0.51690E-04 -0.29119E-04 4512 0.540E-02 0.618E-02
DAV: 8 -0.627833746853E+03 0.37468E-05 -0.22545E-04 4560 0.419E-02 0.309E-02
DAV: 9 -0.627833734033E+03 0.12821E-04 -0.37742E-05 4168 0.220E-02 0.139E-02
DAV: 10 -0.627833733326E+03 0.70691E-06 -0.27543E-05 3064 0.131E-02
10 F= -.62783373E+03 E0= -.62781516E+03 d E =-.306964E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.627836764374E+03 -0.30303E-02 -0.72492E+00 3840 0.619E+00 0.688E-01
DAV: 2 -0.627850973172E+03 -0.14209E-01 -0.17047E-01 4456 0.834E-01 0.328E-01
DAV: 3 -0.627849361647E+03 0.16115E-02 -0.33497E-03 4608 0.171E-01 0.197E-01
DAV: 4 -0.627848789591E+03 0.57206E-03 -0.33230E-03 4512 0.167E-01 0.573E-02
DAV: 5 -0.627848816276E+03 -0.26685E-04 -0.79084E-04 4432 0.718E-02 0.490E-02
DAV: 6 -0.627848817259E+03 -0.98265E-06 -0.21651E-04 4496 0.361E-02 0.247E-02
DAV: 7 -0.627848813119E+03 0.41393E-05 -0.16726E-05 2832 0.136E-02
11 F= -.62784881E+03 E0= -.62783024E+03 d E =-.322044E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628018724647E+03 -0.16991E+00 -0.42554E+01 3840 0.150E+01 0.165E+00
DAV: 2 -0.628096555649E+03 -0.77831E-01 -0.95834E-01 4456 0.201E+00 0.814E-01
DAV: 3 -0.628088054717E+03 0.85009E-02 -0.22373E-02 4608 0.405E-01 0.510E-01
DAV: 4 -0.628085375627E+03 0.26791E-02 -0.17508E-02 4448 0.364E-01 0.167E-01
DAV: 5 -0.628085449109E+03 -0.73481E-04 -0.33955E-03 4472 0.155E-01 0.108E-01
DAV: 6 -0.628085516738E+03 -0.67629E-04 -0.15075E-03 4472 0.101E-01 0.529E-02
DAV: 7 -0.628085486105E+03 0.30633E-04 -0.20779E-04 4416 0.402E-02 0.340E-02
DAV: 8 -0.628085488428E+03 -0.23229E-05 -0.95306E-05 4376 0.226E-02
12 F= -.62808549E+03 E0= -.62806692E+03 d E =-.236675E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628095210573E+03 -0.97245E-02 -0.52362E+01 3840 0.167E+01 0.183E+00
DAV: 2 -0.628190018517E+03 -0.94808E-01 -0.11710E+00 4456 0.224E+00 0.898E-01
DAV: 3 -0.628179577330E+03 0.10441E-01 -0.27348E-02 4608 0.451E-01 0.561E-01
DAV: 4 -0.628176313755E+03 0.32636E-02 -0.21839E-02 4464 0.408E-01 0.183E-01
DAV: 5 -0.628176404132E+03 -0.90376E-04 -0.42640E-03 4432 0.174E-01 0.122E-01
DAV: 6 -0.628176482982E+03 -0.78851E-04 -0.18802E-03 4464 0.113E-01 0.597E-02
DAV: 7 -0.628176447225E+03 0.35758E-04 -0.25916E-04 4384 0.446E-02 0.384E-02
DAV: 8 -0.628176449943E+03 -0.27182E-05 -0.11480E-04 4432 0.248E-02 0.167E-02
DAV: 9 -0.628176448129E+03 0.18141E-05 -0.60057E-06 2304 0.105E-02
13 F= -.62817645E+03 E0= -.62815790E+03 d E =-.327635E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628365389757E+03 -0.18894E+00 -0.40368E+01 3840 0.146E+01 0.152E+00
DAV: 2 -0.628439166880E+03 -0.73777E-01 -0.89542E-01 4464 0.195E+00 0.827E-01
DAV: 3 -0.628431623433E+03 0.75434E-02 -0.18826E-02 4576 0.360E-01 0.520E-01
DAV: 4 -0.628429051790E+03 0.25716E-02 -0.17552E-02 4368 0.368E-01 0.161E-01
DAV: 5 -0.628429106610E+03 -0.54820E-04 -0.38152E-03 4648 0.161E-01 0.113E-01
DAV: 6 -0.628429110747E+03 -0.41365E-05 -0.14460E-03 4472 0.989E-02 0.520E-02
DAV: 7 -0.628429093599E+03 0.17148E-04 -0.15310E-04 4512 0.345E-02 0.297E-02
DAV: 8 -0.628429092524E+03 0.10747E-05 -0.58563E-05 4560 0.202E-02
14 F= -.62842909E+03 E0= -.62841056E+03 d E =-.252644E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628400312404E+03 0.28781E-01 -0.10347E+02 3840 0.233E+01 0.266E+00
DAV: 2 -0.628592392058E+03 -0.19208E+00 -0.23577E+00 4504 0.316E+00 0.133E+00
DAV: 3 -0.628572184476E+03 0.20208E-01 -0.52298E-02 4576 0.577E-01 0.857E-01
DAV: 4 -0.628565131516E+03 0.70530E-02 -0.41508E-02 4424 0.562E-01 0.263E-01
DAV: 5 -0.628565340791E+03 -0.20927E-03 -0.90786E-03 4672 0.246E-01 0.172E-01
DAV: 6 -0.628565379627E+03 -0.38836E-04 -0.34024E-03 4464 0.153E-01 0.830E-02
DAV: 7 -0.628565336498E+03 0.43129E-04 -0.38450E-04 4872 0.571E-02 0.458E-02
DAV: 8 -0.628565335324E+03 0.11740E-05 -0.13553E-04 4536 0.305E-02 0.198E-02
DAV: 9 -0.628565330900E+03 0.44238E-05 -0.16380E-05 3152 0.175E-02
15 F= -.62856533E+03 E0= -.62854681E+03 d E =-.388883E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628682074279E+03 -0.11674E+00 -0.66851E+01 3848 0.187E+01 0.209E+00
DAV: 2 -0.628808395672E+03 -0.12632E+00 -0.15421E+00 4496 0.254E+00 0.102E+00
DAV: 3 -0.628794111615E+03 0.14284E-01 -0.32537E-02 4600 0.472E-01 0.629E-01
DAV: 4 -0.628789129953E+03 0.49817E-02 -0.29142E-02 4496 0.498E-01 0.182E-01
DAV: 5 -0.628789423705E+03 -0.29375E-03 -0.72134E-03 4488 0.208E-01 0.149E-01
DAV: 6 -0.628789372172E+03 0.51533E-04 -0.17873E-03 4464 0.105E-01 0.723E-02
DAV: 7 -0.628789344532E+03 0.27640E-04 -0.15331E-04 4584 0.375E-02 0.408E-02
DAV: 8 -0.628789337213E+03 0.73189E-05 -0.73195E-05 4768 0.291E-02
16 F= -.62878934E+03 E0= -.62877083E+03 d E =-.224006E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628793373924E+03 -0.40294E-02 -0.10578E+01 3840 0.745E+00 0.807E-01
DAV: 2 -0.628812183394E+03 -0.18809E-01 -0.23594E-01 4528 0.998E-01 0.397E-01
DAV: 3 -0.628809883525E+03 0.22999E-02 -0.51512E-03 4600 0.187E-01 0.236E-01
DAV: 4 -0.628809124989E+03 0.75854E-03 -0.44038E-03 4504 0.194E-01 0.675E-02
DAV: 5 -0.628809180910E+03 -0.55920E-04 -0.11400E-03 4472 0.810E-02 0.589E-02
DAV: 6 -0.628809171873E+03 0.90362E-05 -0.24955E-04 4480 0.392E-02 0.293E-02
DAV: 7 -0.628809166124E+03 0.57494E-05 -0.21686E-05 3208 0.143E-02
17 F= -.62880917E+03 E0= -.62879067E+03 d E =-.243835E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628948813843E+03 -0.13964E+00 -0.26404E+01 3840 0.120E+01 0.160E+00
DAV: 2 -0.629001923770E+03 -0.53110E-01 -0.68770E-01 4480 0.175E+00 0.715E-01
DAV: 3 -0.628993730449E+03 0.81933E-02 -0.18625E-02 4600 0.380E-01 0.419E-01
DAV: 4 -0.628990755810E+03 0.29746E-02 -0.16867E-02 4472 0.346E-01 0.140E-01
DAV: 5 -0.628990666964E+03 0.88847E-04 -0.32452E-03 4864 0.164E-01 0.113E-01
DAV: 6 -0.628990651458E+03 0.15505E-04 -0.12162E-03 4448 0.951E-02 0.583E-02
DAV: 7 -0.628990628765E+03 0.22693E-04 -0.14468E-04 4528 0.346E-02 0.391E-02
DAV: 8 -0.628990616188E+03 0.12577E-04 -0.71069E-05 4528 0.240E-02 0.150E-02
DAV: 9 -0.628990613918E+03 0.22707E-05 -0.10677E-05 2832 0.131E-02
18 F= -.62899061E+03 E0= -.62897211E+03 d E =-.181448E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.628998769708E+03 -0.81535E-02 -0.31092E+00 3872 0.414E+00 0.549E-01
DAV: 2 -0.629005007585E+03 -0.62379E-02 -0.81106E-02 4480 0.603E-01 0.253E-01
DAV: 3 -0.629003989198E+03 0.10184E-02 -0.21850E-03 4600 0.131E-01 0.147E-01
DAV: 4 -0.629003625736E+03 0.36346E-03 -0.20341E-03 4480 0.120E-01 0.484E-02
DAV: 5 -0.629003615974E+03 0.97616E-05 -0.39937E-04 4824 0.574E-02 0.397E-02
DAV: 6 -0.629003614474E+03 0.15004E-05 -0.14654E-04 4456 0.331E-02 0.208E-02
DAV: 7 -0.629003611139E+03 0.33353E-05 -0.16152E-05 2840 0.122E-02
19 F= -.62900361E+03 E0= -.62898511E+03 d E =-.194445E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629106707849E+03 -0.10309E+00 -0.25584E+01 3840 0.119E+01 0.127E+00
DAV: 2 -0.629151618968E+03 -0.44911E-01 -0.56444E-01 4528 0.159E+00 0.606E-01
DAV: 3 -0.629147064951E+03 0.45540E-02 -0.15252E-02 4544 0.318E-01 0.371E-01
DAV: 4 -0.629145312066E+03 0.17529E-02 -0.94754E-03 4472 0.281E-01 0.121E-01
DAV: 5 -0.629145399497E+03 -0.87431E-04 -0.22216E-03 4528 0.122E-01 0.886E-02
DAV: 6 -0.629145389229E+03 0.10268E-04 -0.78507E-04 4424 0.729E-02 0.451E-02
DAV: 7 -0.629145377958E+03 0.11271E-04 -0.79264E-05 4472 0.250E-02 0.250E-02
DAV: 8 -0.629145377034E+03 0.92483E-06 -0.29271E-05 3696 0.147E-02
20 F= -.62914538E+03 E0= -.62912688E+03 d E =-.141766E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629154804999E+03 -0.94270E-02 -0.85495E+00 3856 0.685E+00 0.736E-01
DAV: 2 -0.629169696175E+03 -0.14891E-01 -0.18754E-01 4528 0.915E-01 0.349E-01
DAV: 3 -0.629168160886E+03 0.15353E-02 -0.50457E-03 4544 0.183E-01 0.214E-01
DAV: 4 -0.629167572454E+03 0.58843E-03 -0.30840E-03 4480 0.161E-01 0.691E-02
DAV: 5 -0.629167603393E+03 -0.30939E-04 -0.74081E-04 4520 0.702E-02 0.502E-02
DAV: 6 -0.629167600696E+03 0.26965E-05 -0.25315E-04 4424 0.413E-02 0.261E-02
DAV: 7 -0.629167596386E+03 0.43108E-05 -0.22972E-05 2984 0.144E-02
21 F= -.62916760E+03 E0= -.62914910E+03 d E =-.163985E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629196255547E+03 -0.28655E-01 -0.34530E+01 3840 0.138E+01 0.160E+00
DAV: 2 -0.629265447155E+03 -0.69192E-01 -0.83804E-01 4504 0.193E+00 0.737E-01
DAV: 3 -0.629258133734E+03 0.73134E-02 -0.19280E-02 4600 0.379E-01 0.447E-01
DAV: 4 -0.629255577110E+03 0.25566E-02 -0.18264E-02 4464 0.381E-01 0.148E-01
DAV: 5 -0.629255593393E+03 -0.16283E-04 -0.36437E-03 4464 0.159E-01 0.120E-01
DAV: 6 -0.629255582411E+03 0.10983E-04 -0.15205E-03 4416 0.100E-01 0.545E-02
DAV: 7 -0.629255567106E+03 0.15305E-04 -0.17636E-04 4480 0.343E-02 0.344E-02
DAV: 8 -0.629255566419E+03 0.68714E-06 -0.59097E-05 4432 0.200E-02
22 F= -.62925557E+03 E0= -.62923707E+03 d E =-.879700E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629255591244E+03 -0.24138E-04 -0.18261E-02 3968 0.317E-01 0.354E-02
DAV: 2 -0.629255626040E+03 -0.34797E-04 -0.41634E-04 4504 0.429E-02 0.180E-02
DAV: 3 -0.629255621665E+03 0.43756E-05 -0.85169E-06 2520 0.883E-03
23 F= -.62925562E+03 E0= -.62923712E+03 d E =-.880253E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629289954755E+03 -0.34329E-01 -0.15958E+01 3840 0.931E+00 0.102E+00
DAV: 2 -0.629319817697E+03 -0.29863E-01 -0.36074E-01 4480 0.126E+00 0.463E-01
DAV: 3 -0.629316564598E+03 0.32531E-02 -0.81071E-03 4544 0.241E-01 0.278E-01
DAV: 4 -0.629315401587E+03 0.11630E-02 -0.67422E-03 4480 0.234E-01 0.894E-02
DAV: 5 -0.629315432368E+03 -0.30780E-04 -0.14917E-03 4480 0.100E-01 0.744E-02
DAV: 6 -0.629315423640E+03 0.87278E-05 -0.50970E-04 4480 0.570E-02 0.364E-02
DAV: 7 -0.629315414010E+03 0.96294E-05 -0.51509E-05 4312 0.212E-02
24 F= -.62931541E+03 E0= -.62929691E+03 d E =-.597923E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629316601491E+03 -0.11779E-02 -0.43259E+00 3840 0.485E+00 0.531E-01
DAV: 2 -0.629324622302E+03 -0.80208E-02 -0.97195E-02 4480 0.657E-01 0.239E-01
DAV: 3 -0.629323755873E+03 0.86643E-03 -0.22188E-03 4536 0.126E-01 0.143E-01
DAV: 4 -0.629323442683E+03 0.31319E-03 -0.17724E-03 4480 0.121E-01 0.461E-02
DAV: 5 -0.629323451387E+03 -0.87038E-05 -0.40059E-04 4504 0.521E-02 0.388E-02
DAV: 6 -0.629323448310E+03 0.30764E-05 -0.13773E-04 4440 0.298E-02 0.193E-02
DAV: 7 -0.629323445391E+03 0.29192E-05 -0.12661E-05 2744 0.112E-02
25 F= -.62932345E+03 E0= -.62930494E+03 d E =-.678237E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629356981648E+03 -0.33533E-01 -0.11307E+01 3840 0.779E+00 0.742E-01
DAV: 2 -0.629375964043E+03 -0.18982E-01 -0.23834E-01 4480 0.103E+00 0.384E-01
DAV: 3 -0.629373961148E+03 0.20029E-02 -0.54736E-03 4552 0.191E-01 0.239E-01
DAV: 4 -0.629373151809E+03 0.80934E-03 -0.47339E-03 4480 0.193E-01 0.793E-02
DAV: 5 -0.629373165998E+03 -0.14189E-04 -0.98529E-04 4528 0.813E-02 0.613E-02
DAV: 6 -0.629373155245E+03 0.10753E-04 -0.45060E-04 4416 0.559E-02 0.283E-02
DAV: 7 -0.629373149382E+03 0.58632E-05 -0.49588E-05 4032 0.197E-02
26 F= -.62937315E+03 E0= -.62935464E+03 d E =-.497040E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629373221769E+03 -0.66524E-04 -0.11427E+01 3840 0.783E+00 0.749E-01
DAV: 2 -0.629392467877E+03 -0.19246E-01 -0.24148E-01 4480 0.104E+00 0.385E-01
DAV: 3 -0.629390447908E+03 0.20200E-02 -0.55706E-03 4552 0.193E-01 0.240E-01
DAV: 4 -0.629389631629E+03 0.81628E-03 -0.47678E-03 4480 0.194E-01 0.797E-02
DAV: 5 -0.629389645343E+03 -0.13715E-04 -0.99331E-04 4528 0.819E-02 0.616E-02
DAV: 6 -0.629389634652E+03 0.10691E-04 -0.45590E-04 4408 0.563E-02 0.285E-02
DAV: 7 -0.629389628601E+03 0.60511E-05 -0.50453E-05 4080 0.199E-02
27 F= -.62938963E+03 E0= -.62937112E+03 d E =-.661832E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629411030935E+03 -0.21396E-01 -0.14676E+01 3840 0.891E+00 0.914E-01
DAV: 2 -0.629437651504E+03 -0.26621E-01 -0.32666E-01 4456 0.121E+00 0.460E-01
DAV: 3 -0.629434834216E+03 0.28173E-02 -0.68651E-03 4584 0.219E-01 0.285E-01
DAV: 4 -0.629433726949E+03 0.11073E-02 -0.77216E-03 4472 0.245E-01 0.950E-02
DAV: 5 -0.629433722092E+03 0.48571E-05 -0.16410E-03 4520 0.105E-01 0.774E-02
DAV: 6 -0.629433694748E+03 0.27344E-04 -0.59911E-04 4400 0.624E-02 0.335E-02
DAV: 7 -0.629433687604E+03 0.71437E-05 -0.59277E-05 4328 0.205E-02
28 F= -.62943369E+03 E0= -.62941516E+03 d E =-.440590E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629433775201E+03 -0.80453E-04 -0.28395E+00 3840 0.392E+00 0.403E-01
DAV: 2 -0.629438916539E+03 -0.51413E-02 -0.63055E-02 4448 0.531E-01 0.202E-01
DAV: 3 -0.629438366739E+03 0.54980E-03 -0.13112E-03 4576 0.960E-02 0.125E-01
DAV: 4 -0.629438149320E+03 0.21742E-03 -0.14724E-03 4472 0.108E-01 0.409E-02
DAV: 5 -0.629438149809E+03 -0.48893E-06 -0.32510E-04 4512 0.464E-02 0.339E-02
DAV: 6 -0.629438144227E+03 0.55823E-05 -0.11246E-04 4424 0.271E-02 0.149E-02
DAV: 7 -0.629438142464E+03 0.17625E-05 -0.99557E-06 2536 0.916E-03
29 F= -.62943814E+03 E0= -.62941961E+03 d E =-.485139E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629460753777E+03 -0.22610E-01 -0.10223E+01 3840 0.746E+00 0.697E-01
DAV: 2 -0.629479141316E+03 -0.18388E-01 -0.21546E-01 4464 0.976E-01 0.367E-01
DAV: 3 -0.629477564926E+03 0.15764E-02 -0.43445E-03 4592 0.173E-01 0.227E-01
DAV: 4 -0.629476984281E+03 0.58064E-03 -0.40826E-03 4472 0.183E-01 0.693E-02
DAV: 5 -0.629477005814E+03 -0.21533E-04 -0.89516E-04 4472 0.777E-02 0.579E-02
DAV: 6 -0.629476999938E+03 0.58763E-05 -0.34851E-04 4464 0.486E-02 0.280E-02
DAV: 7 -0.629476995075E+03 0.48626E-05 -0.33167E-05 3280 0.163E-02
30 F= -.62947700E+03 E0= -.62945846E+03 d E =-.388526E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629476530712E+03 0.46923E-03 -0.81986E+00 3840 0.668E+00 0.628E-01
DAV: 2 -0.629491280842E+03 -0.14750E-01 -0.17313E-01 4464 0.876E-01 0.328E-01
DAV: 3 -0.629490020179E+03 0.12607E-02 -0.35186E-03 4600 0.155E-01 0.203E-01
DAV: 4 -0.629489552968E+03 0.46721E-03 -0.32475E-03 4472 0.164E-01 0.621E-02
DAV: 5 -0.629489571046E+03 -0.18078E-04 -0.71860E-04 4512 0.697E-02 0.521E-02
DAV: 6 -0.629489565914E+03 0.51320E-05 -0.27645E-04 4472 0.434E-02 0.253E-02
DAV: 7 -0.629489561842E+03 0.40718E-05 -0.25770E-05 2928 0.145E-02
31 F= -.62948956E+03 E0= -.62947103E+03 d E =-.514194E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629505029355E+03 -0.15463E-01 -0.12612E+01 3840 0.832E+00 0.840E-01
DAV: 2 -0.629527846514E+03 -0.22817E-01 -0.26816E-01 4472 0.109E+00 0.397E-01
DAV: 3 -0.629525655941E+03 0.21906E-02 -0.53274E-03 4608 0.199E-01 0.241E-01
DAV: 4 -0.629524763804E+03 0.89214E-03 -0.43097E-03 4480 0.202E-01 0.650E-02
DAV: 5 -0.629524843616E+03 -0.79813E-04 -0.12395E-03 4520 0.864E-02 0.593E-02
DAV: 6 -0.629524832159E+03 0.11458E-04 -0.22644E-04 4448 0.378E-02 0.326E-02
DAV: 7 -0.629524826502E+03 0.56566E-05 -0.18344E-05 3000 0.132E-02
32 F= -.62952483E+03 E0= -.62950629E+03 d E =-.352647E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629524631225E+03 0.20093E-03 -0.35585E+00 3840 0.442E+00 0.447E-01
DAV: 2 -0.629531031662E+03 -0.64004E-02 -0.75419E-02 4472 0.580E-01 0.210E-01
DAV: 3 -0.629530413992E+03 0.61767E-03 -0.15138E-03 4608 0.106E-01 0.127E-01
DAV: 4 -0.629530160038E+03 0.25395E-03 -0.12025E-03 4480 0.107E-01 0.345E-02
DAV: 5 -0.629530182442E+03 -0.22404E-04 -0.35249E-04 4560 0.463E-02 0.316E-02
DAV: 6 -0.629530178842E+03 0.35996E-05 -0.65606E-05 4256 0.205E-02
33 F= -.62953018E+03 E0= -.62951164E+03 d E =-.406170E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629535405825E+03 -0.52234E-02 -0.15853E+01 3840 0.931E+00 0.896E-01
DAV: 2 -0.629563395442E+03 -0.27990E-01 -0.33311E-01 4472 0.122E+00 0.451E-01
DAV: 3 -0.629560786510E+03 0.26089E-02 -0.66914E-03 4616 0.216E-01 0.278E-01
DAV: 4 -0.629559788271E+03 0.99824E-03 -0.57642E-03 4472 0.216E-01 0.768E-02
DAV: 5 -0.629559859264E+03 -0.70993E-04 -0.13382E-03 4456 0.912E-02 0.633E-02
DAV: 6 -0.629559861308E+03 -0.20439E-05 -0.40216E-04 4456 0.522E-02 0.319E-02
DAV: 7 -0.629559854049E+03 0.72588E-05 -0.41418E-05 3512 0.187E-02
34 F= -.62955985E+03 E0= -.62954131E+03 d E =-.296752E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629559297501E+03 0.56381E-03 -0.17515E+00 3840 0.310E+00 0.300E-01
DAV: 2 -0.629562383954E+03 -0.30865E-02 -0.36772E-02 4464 0.405E-01 0.149E-01
DAV: 3 -0.629562098940E+03 0.28501E-03 -0.75188E-04 4616 0.719E-02 0.914E-02
DAV: 4 -0.629561990171E+03 0.10877E-03 -0.60681E-04 4480 0.703E-02 0.251E-02
DAV: 5 -0.629561998846E+03 -0.86755E-05 -0.14363E-04 4432 0.298E-02 0.207E-02
DAV: 6 -0.629561999046E+03 -0.19945E-06 -0.41921E-05 3696 0.171E-02
35 F= -.62956200E+03 E0= -.62954345E+03 d E =-.318202E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629566251696E+03 -0.42528E-02 -0.14811E+01 3840 0.896E+00 0.813E-01
DAV: 2 -0.629593103698E+03 -0.26852E-01 -0.31415E-01 4472 0.118E+00 0.440E-01
DAV: 3 -0.629590908508E+03 0.21952E-02 -0.60777E-03 4600 0.202E-01 0.275E-01
DAV: 4 -0.629590005277E+03 0.90323E-03 -0.61255E-03 4448 0.221E-01 0.837E-02
DAV: 5 -0.629590027728E+03 -0.22451E-04 -0.13362E-03 4512 0.944E-02 0.700E-02
DAV: 6 -0.629590010202E+03 0.17526E-04 -0.49541E-04 4424 0.585E-02 0.319E-02
DAV: 7 -0.629590004228E+03 0.59742E-05 -0.50086E-05 3680 0.182E-02
36 F= -.62959000E+03 E0= -.62957146E+03 d E =-.280052E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629588609163E+03 0.14010E-02 -0.28067E+00 3840 0.390E+00 0.353E-01
DAV: 2 -0.629593699728E+03 -0.50906E-02 -0.59514E-02 4472 0.512E-01 0.190E-01
DAV: 3 -0.629593284807E+03 0.41492E-03 -0.11550E-03 4600 0.879E-02 0.119E-01
DAV: 4 -0.629593113287E+03 0.17152E-03 -0.11456E-03 4456 0.956E-02 0.361E-02
DAV: 5 -0.629593117976E+03 -0.46893E-05 -0.25233E-04 4520 0.411E-02 0.303E-02
DAV: 6 -0.629593114677E+03 0.32988E-05 -0.93546E-05 4368 0.255E-02
37 F= -.62959311E+03 E0= -.62957457E+03 d E =-.311156E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629591537479E+03 0.15805E-02 -0.17807E+01 3840 0.984E+00 0.966E-01
DAV: 2 -0.629623590074E+03 -0.32053E-01 -0.37908E-01 4480 0.130E+00 0.472E-01
DAV: 3 -0.629620566957E+03 0.30231E-02 -0.72050E-03 4616 0.230E-01 0.288E-01
DAV: 4 -0.629619385759E+03 0.11812E-02 -0.74015E-03 4488 0.254E-01 0.849E-02
DAV: 5 -0.629619451096E+03 -0.65338E-04 -0.18164E-03 4432 0.105E-01 0.782E-02
DAV: 6 -0.629619427697E+03 0.23399E-04 -0.47346E-04 4440 0.552E-02 0.380E-02
DAV: 7 -0.629619420475E+03 0.72221E-05 -0.43652E-05 3608 0.175E-02
38 F= -.62961942E+03 E0= -.62960087E+03 d E =-.263058E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629618756305E+03 0.67139E-03 -0.14649E+00 3840 0.282E+00 0.278E-01
DAV: 2 -0.629621393751E+03 -0.26374E-02 -0.31245E-02 4472 0.372E-01 0.134E-01
DAV: 3 -0.629621141868E+03 0.25188E-03 -0.59803E-04 4616 0.664E-02 0.816E-02
DAV: 4 -0.629621042389E+03 0.99479E-04 -0.60980E-04 4496 0.734E-02 0.243E-02
DAV: 5 -0.629621047792E+03 -0.54033E-05 -0.15291E-04 4400 0.305E-02 0.227E-02
DAV: 6 -0.629621045466E+03 0.23258E-05 -0.38443E-05 3736 0.159E-02
39 F= -.62962105E+03 E0= -.62960249E+03 d E =-.279308E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629619710457E+03 0.13373E-02 -0.15392E+01 3840 0.919E+00 0.835E-01
DAV: 2 -0.629646930946E+03 -0.27220E-01 -0.32107E-01 4480 0.120E+00 0.443E-01
DAV: 3 -0.629644615175E+03 0.23158E-02 -0.65502E-03 4608 0.213E-01 0.273E-01
DAV: 4 -0.629643702264E+03 0.91291E-03 -0.57550E-03 4480 0.221E-01 0.813E-02
DAV: 5 -0.629643747757E+03 -0.45493E-04 -0.13280E-03 4464 0.928E-02 0.691E-02
DAV: 6 -0.629643734392E+03 0.13365E-04 -0.45700E-04 4416 0.556E-02 0.333E-02
DAV: 7 -0.629643727430E+03 0.69618E-05 -0.43444E-05 3496 0.191E-02
40 F= -.62964373E+03 E0= -.62962517E+03 d E =-.226820E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629643209350E+03 0.52504E-03 -0.10839E+00 3840 0.244E+00 0.223E-01
DAV: 2 -0.629645132061E+03 -0.19227E-02 -0.22705E-02 4472 0.319E-01 0.116E-01
DAV: 3 -0.629644970871E+03 0.16119E-03 -0.47249E-04 4600 0.570E-02 0.716E-02
DAV: 4 -0.629644906474E+03 0.64398E-04 -0.39144E-04 4488 0.582E-02 0.215E-02
DAV: 5 -0.629644909959E+03 -0.34858E-05 -0.93238E-05 4288 0.247E-02
41 F= -.62964491E+03 E0= -.62962635E+03 d E =-.238645E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629639720413E+03 0.51861E-02 -0.15864E+01 3840 0.936E+00 0.833E-01
DAV: 2 -0.629668450067E+03 -0.28730E-01 -0.33189E-01 4488 0.122E+00 0.455E-01
DAV: 3 -0.629666285117E+03 0.21649E-02 -0.64423E-03 4616 0.208E-01 0.286E-01
DAV: 4 -0.629665373786E+03 0.91133E-03 -0.62954E-03 4480 0.232E-01 0.865E-02
DAV: 5 -0.629665402102E+03 -0.28316E-04 -0.14933E-03 4472 0.100E-01 0.726E-02
DAV: 6 -0.629665377531E+03 0.24570E-04 -0.52874E-04 4440 0.597E-02 0.330E-02
DAV: 7 -0.629665370087E+03 0.74446E-05 -0.49488E-05 3680 0.190E-02
42 F= -.62966537E+03 E0= -.62964682E+03 d E =-.204601E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629665028680E+03 0.34885E-03 -0.53683E-01 3856 0.172E+00 0.154E-01
DAV: 2 -0.629666010169E+03 -0.98149E-03 -0.11327E-02 4488 0.225E-01 0.828E-02
DAV: 3 -0.629665937179E+03 0.72990E-04 -0.22279E-04 4624 0.384E-02 0.520E-02
DAV: 4 -0.629665905433E+03 0.31746E-04 -0.20399E-04 4488 0.418E-02 0.156E-02
DAV: 5 -0.629665906448E+03 -0.10156E-05 -0.49345E-05 3792 0.185E-02
43 F= -.62966591E+03 E0= -.62964735E+03 d E =-.209965E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629661401896E+03 0.45035E-02 -0.14030E+01 3840 0.880E+00 0.828E-01
DAV: 2 -0.629686318586E+03 -0.24917E-01 -0.29184E-01 4456 0.114E+00 0.419E-01
DAV: 3 -0.629684369435E+03 0.19492E-02 -0.59628E-03 4544 0.197E-01 0.260E-01
DAV: 4 -0.629683529201E+03 0.84023E-03 -0.47610E-03 4480 0.204E-01 0.762E-02
DAV: 5 -0.629683579745E+03 -0.50544E-04 -0.11812E-03 4512 0.875E-02 0.623E-02
DAV: 6 -0.629683568810E+03 0.10935E-04 -0.38403E-04 4440 0.509E-02 0.307E-02
DAV: 7 -0.629683562105E+03 0.67052E-05 -0.35057E-05 3096 0.174E-02
44 F= -.62968356E+03 E0= -.62966501E+03 d E =-.176557E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629682864414E+03 0.70440E-03 -0.10367E+00 3840 0.239E+00 0.227E-01
DAV: 2 -0.629684708018E+03 -0.18436E-02 -0.21657E-02 4456 0.312E-01 0.113E-01
DAV: 3 -0.629684564511E+03 0.14351E-03 -0.45308E-04 4536 0.540E-02 0.705E-02
DAV: 4 -0.629684501088E+03 0.63422E-04 -0.33718E-04 4480 0.548E-02 0.207E-02
DAV: 5 -0.629684505225E+03 -0.41364E-05 -0.86990E-05 4312 0.237E-02
45 F= -.62968451E+03 E0= -.62966595E+03 d E =-.185988E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629682630341E+03 0.18707E-02 -0.12019E+01 3840 0.814E+00 0.748E-01
DAV: 2 -0.629704271357E+03 -0.21641E-01 -0.25142E-01 4448 0.106E+00 0.389E-01
DAV: 3 -0.629702640786E+03 0.16306E-02 -0.46828E-03 4592 0.175E-01 0.244E-01
DAV: 4 -0.629701941479E+03 0.69931E-03 -0.46214E-03 4464 0.200E-01 0.720E-02
DAV: 5 -0.629701972158E+03 -0.30679E-04 -0.11046E-03 4480 0.837E-02 0.623E-02
DAV: 6 -0.629701951757E+03 0.20401E-04 -0.35394E-04 4432 0.485E-02 0.285E-02
DAV: 7 -0.629701946769E+03 0.49884E-05 -0.34173E-05 3080 0.157E-02
46 F= -.62970195E+03 E0= -.62968339E+03 d E =-.174415E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629699384149E+03 0.25676E-02 -0.31277E+00 3840 0.415E+00 0.381E-01
DAV: 2 -0.629705009668E+03 -0.56255E-02 -0.65373E-02 4448 0.540E-01 0.198E-01
DAV: 3 -0.629704579875E+03 0.42979E-03 -0.12225E-03 4592 0.895E-02 0.124E-01
DAV: 4 -0.629704392367E+03 0.18751E-03 -0.11834E-03 4472 0.101E-01 0.361E-02
DAV: 5 -0.629704401346E+03 -0.89796E-05 -0.28767E-04 4472 0.427E-02 0.314E-02
DAV: 6 -0.629704396206E+03 0.51399E-05 -0.90036E-05 4272 0.245E-02
47 F= -.62970440E+03 E0= -.62968583E+03 d E =-.198910E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629698158601E+03 0.62427E-02 -0.13902E+01 3840 0.875E+00 0.852E-01
DAV: 2 -0.629723655755E+03 -0.25497E-01 -0.29508E-01 4464 0.115E+00 0.423E-01
DAV: 3 -0.629721651567E+03 0.20042E-02 -0.54509E-03 4592 0.195E-01 0.265E-01
DAV: 4 -0.629720820059E+03 0.83151E-03 -0.57301E-03 4488 0.224E-01 0.788E-02
DAV: 5 -0.629720857880E+03 -0.37821E-04 -0.13966E-03 4464 0.936E-02 0.698E-02
DAV: 6 -0.629720834630E+03 0.23250E-04 -0.38021E-04 4432 0.492E-02 0.324E-02
DAV: 7 -0.629720827469E+03 0.71611E-05 -0.38824E-05 3464 0.165E-02
48 F= -.62972083E+03 E0= -.62970226E+03 d E =-.164313E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629720059555E+03 0.77507E-03 -0.10520E+00 3856 0.241E+00 0.235E-01
DAV: 2 -0.629721993062E+03 -0.19335E-02 -0.22364E-02 4464 0.316E-01 0.116E-01
DAV: 3 -0.629721838687E+03 0.15438E-03 -0.41504E-04 4592 0.541E-02 0.725E-02
DAV: 4 -0.629721774054E+03 0.64633E-04 -0.43691E-04 4488 0.622E-02 0.218E-02
DAV: 5 -0.629721777047E+03 -0.29939E-05 -0.10854E-04 4328 0.262E-02 0.193E-02
DAV: 6 -0.629721775107E+03 0.19402E-05 -0.28255E-05 3104 0.137E-02
49 F= -.62972178E+03 E0= -.62970321E+03 d E =-.173789E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629715865329E+03 0.59117E-02 -0.14069E+01 3840 0.879E+00 0.794E-01
DAV: 2 -0.629741480310E+03 -0.25615E-01 -0.29478E-01 4448 0.114E+00 0.429E-01
DAV: 3 -0.629739587192E+03 0.18931E-02 -0.52917E-03 4616 0.188E-01 0.270E-01
DAV: 4 -0.629738791822E+03 0.79537E-03 -0.53538E-03 4496 0.215E-01 0.767E-02
DAV: 5 -0.629738827709E+03 -0.35887E-04 -0.12754E-03 4456 0.903E-02 0.679E-02
DAV: 6 -0.629738806665E+03 0.21044E-04 -0.37104E-04 4456 0.494E-02 0.324E-02
DAV: 7 -0.629738799579E+03 0.70854E-05 -0.37029E-05 3344 0.170E-02
50 F= -.62973880E+03 E0= -.62972023E+03 d E =-.170245E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629736239689E+03 0.25670E-02 -0.27273E+00 3840 0.387E+00 0.350E-01
DAV: 2 -0.629741208940E+03 -0.49693E-02 -0.57208E-02 4440 0.504E-01 0.188E-01
DAV: 3 -0.629740841450E+03 0.36749E-03 -0.10336E-03 4616 0.830E-02 0.118E-01
DAV: 4 -0.629740685177E+03 0.15627E-03 -0.10273E-03 4496 0.944E-02 0.336E-02
DAV: 5 -0.629740692598E+03 -0.74209E-05 -0.24768E-04 4456 0.398E-02 0.299E-02
DAV: 6 -0.629740688463E+03 0.41343E-05 -0.72235E-05 4216 0.219E-02
51 F= -.62974069E+03 E0= -.62972212E+03 d E =-.189134E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629739180275E+03 0.15123E-02 -0.10724E+01 3840 0.768E+00 0.679E-01
DAV: 2 -0.629758683889E+03 -0.19504E-01 -0.22231E-01 4424 0.994E-01 0.372E-01
DAV: 3 -0.629757368806E+03 0.13151E-02 -0.39570E-03 4600 0.160E-01 0.236E-01
DAV: 4 -0.629756812304E+03 0.55650E-03 -0.41061E-03 4480 0.188E-01 0.696E-02
DAV: 5 -0.629756830124E+03 -0.17820E-04 -0.95850E-04 4456 0.785E-02 0.594E-02
DAV: 6 -0.629756809265E+03 0.20859E-04 -0.33638E-04 4424 0.474E-02 0.257E-02
DAV: 7 -0.629756804228E+03 0.50377E-05 -0.33711E-05 3048 0.153E-02
52 F= -.62975680E+03 E0= -.62973824E+03 d E =-.161158E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629748819389E+03 0.79899E-02 -0.84277E+00 3840 0.681E+00 0.600E-01
DAV: 2 -0.629764124658E+03 -0.15305E-01 -0.17466E-01 4416 0.881E-01 0.330E-01
DAV: 3 -0.629763078645E+03 0.10460E-02 -0.31197E-03 4592 0.143E-01 0.209E-01
DAV: 4 -0.629762629363E+03 0.44928E-03 -0.32243E-03 4480 0.167E-01 0.616E-02
DAV: 5 -0.629762643978E+03 -0.14615E-04 -0.75879E-04 4472 0.699E-02 0.526E-02
DAV: 6 -0.629762627597E+03 0.16381E-04 -0.26398E-04 4392 0.420E-02 0.229E-02
DAV: 7 -0.629762623614E+03 0.39835E-05 -0.26008E-05 2848 0.136E-02
53 F= -.62976262E+03 E0= -.62974406E+03 d E =-.219352E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629761183003E+03 0.14446E-02 -0.11557E+01 3840 0.801E+00 0.782E-01
DAV: 2 -0.629782412643E+03 -0.21230E-01 -0.24469E-01 4472 0.105E+00 0.393E-01
DAV: 3 -0.629780812584E+03 0.16001E-02 -0.46632E-03 4568 0.179E-01 0.245E-01
DAV: 4 -0.629780183173E+03 0.62941E-03 -0.45565E-03 4472 0.198E-01 0.743E-02
DAV: 5 -0.629780199310E+03 -0.16137E-04 -0.10411E-03 4424 0.832E-02 0.610E-02
DAV: 6 -0.629780183874E+03 0.15436E-04 -0.36488E-04 4416 0.483E-02 0.267E-02
DAV: 7 -0.629780179401E+03 0.44729E-05 -0.31549E-05 2896 0.152E-02
54 F= -.62978018E+03 E0= -.62976163E+03 d E =-.175558E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629777317882E+03 0.28660E-02 -0.35831E+00 3840 0.446E+00 0.437E-01
DAV: 2 -0.629783899261E+03 -0.65814E-02 -0.75920E-02 4464 0.585E-01 0.219E-01
DAV: 3 -0.629783404677E+03 0.49458E-03 -0.14513E-03 4568 0.100E-01 0.136E-01
DAV: 4 -0.629783209555E+03 0.19512E-03 -0.13988E-03 4472 0.110E-01 0.412E-02
DAV: 5 -0.629783215084E+03 -0.55297E-05 -0.32377E-04 4440 0.464E-02 0.338E-02
DAV: 6 -0.629783210398E+03 0.46865E-05 -0.11133E-04 4336 0.267E-02 0.149E-02
DAV: 7 -0.629783208987E+03 0.14112E-05 -0.95032E-06 2488 0.849E-03
55 F= -.62978321E+03 E0= -.62976468E+03 d E =-.205854E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629782020596E+03 0.11898E-02 -0.10102E+01 3840 0.746E+00 0.690E-01
DAV: 2 -0.629800019948E+03 -0.17999E-01 -0.20797E-01 4448 0.964E-01 0.367E-01
DAV: 3 -0.629798632362E+03 0.13876E-02 -0.38572E-03 4576 0.163E-01 0.229E-01
DAV: 4 -0.629798112195E+03 0.52017E-03 -0.39723E-03 4440 0.183E-01 0.655E-02
DAV: 5 -0.629798131511E+03 -0.19316E-04 -0.94085E-04 4424 0.766E-02 0.575E-02
DAV: 6 -0.629798114777E+03 0.16734E-04 -0.28178E-04 4408 0.421E-02 0.267E-02
DAV: 7 -0.629798109861E+03 0.49165E-05 -0.26830E-05 2984 0.141E-02
56 F= -.62979811E+03 E0= -.62977958E+03 d E =-.149009E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629792386851E+03 0.57279E-02 -0.61642E+00 3840 0.583E+00 0.539E-01
DAV: 2 -0.629803369326E+03 -0.10982E-01 -0.12698E-01 4440 0.754E-01 0.287E-01
DAV: 3 -0.629802525588E+03 0.84374E-03 -0.23675E-03 4592 0.127E-01 0.179E-01
DAV: 4 -0.629802208137E+03 0.31745E-03 -0.24143E-03 4448 0.143E-01 0.510E-02
DAV: 5 -0.629802220184E+03 -0.12047E-04 -0.57498E-04 4432 0.599E-02 0.449E-02
DAV: 6 -0.629802209956E+03 0.10227E-04 -0.17158E-04 4336 0.329E-02 0.209E-02
DAV: 7 -0.629802206887E+03 0.30692E-05 -0.16333E-05 2648 0.111E-02
57 F= -.62980221E+03 E0= -.62978367E+03 d E =-.189979E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629801688830E+03 0.52113E-03 -0.92417E+00 3840 0.713E+00 0.679E-01
DAV: 2 -0.629818121487E+03 -0.16433E-01 -0.19104E-01 4464 0.929E-01 0.362E-01
DAV: 3 -0.629816862363E+03 0.12591E-02 -0.35859E-03 4552 0.158E-01 0.225E-01
DAV: 4 -0.629816410320E+03 0.45204E-03 -0.38146E-03 4464 0.180E-01 0.655E-02
DAV: 5 -0.629816418676E+03 -0.83562E-05 -0.87222E-04 4432 0.752E-02 0.569E-02
DAV: 6 -0.629816400919E+03 0.17757E-04 -0.30477E-04 4416 0.441E-02 0.249E-02
DAV: 7 -0.629816395581E+03 0.53376E-05 -0.27603E-05 3000 0.145E-02
58 F= -.62981640E+03 E0= -.62979786E+03 d E =-.141887E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629813959062E+03 0.24419E-02 -0.32973E+00 3840 0.426E+00 0.406E-01
DAV: 2 -0.629819822557E+03 -0.58635E-02 -0.68220E-02 4464 0.555E-01 0.216E-01
DAV: 3 -0.629819372080E+03 0.45048E-03 -0.12861E-03 4552 0.947E-02 0.134E-01
DAV: 4 -0.629819209729E+03 0.16235E-03 -0.13493E-03 4472 0.107E-01 0.389E-02
DAV: 5 -0.629819213263E+03 -0.35337E-05 -0.31268E-04 4432 0.450E-02 0.339E-02
DAV: 6 -0.629819206996E+03 0.62669E-05 -0.10710E-04 4328 0.262E-02 0.150E-02
DAV: 7 -0.629819205013E+03 0.19834E-05 -0.95015E-06 2440 0.870E-03
59 F= -.62981921E+03 E0= -.62980067E+03 d E =-.169981E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629817460331E+03 0.17467E-02 -0.10390E+01 3840 0.756E+00 0.718E-01
DAV: 2 -0.629835704000E+03 -0.18244E-01 -0.21257E-01 4448 0.978E-01 0.392E-01
DAV: 3 -0.629834270902E+03 0.14331E-02 -0.40277E-03 4584 0.169E-01 0.242E-01
DAV: 4 -0.629833777965E+03 0.49294E-03 -0.43004E-03 4448 0.189E-01 0.703E-02
DAV: 5 -0.629833780765E+03 -0.28006E-05 -0.92179E-04 4432 0.795E-02 0.587E-02
DAV: 6 -0.629833767448E+03 0.13317E-04 -0.34814E-04 4432 0.475E-02 0.254E-02
DAV: 7 -0.629833762470E+03 0.49785E-05 -0.29874E-05 2944 0.154E-02
60 F= -.62983376E+03 E0= -.62981524E+03 d E =-.145575E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629832089468E+03 0.16780E-02 -0.23118E+00 3840 0.357E+00 0.339E-01
DAV: 2 -0.629836160439E+03 -0.40710E-02 -0.47465E-02 4448 0.462E-01 0.184E-01
DAV: 3 -0.629835842122E+03 0.31832E-03 -0.89795E-04 4568 0.797E-02 0.114E-01
DAV: 4 -0.629835732855E+03 0.10927E-03 -0.94607E-04 4456 0.888E-02 0.330E-02
DAV: 5 -0.629835734177E+03 -0.13227E-05 -0.20542E-04 4440 0.374E-02 0.277E-02
DAV: 6 -0.629835731178E+03 0.29991E-05 -0.75675E-05 4112 0.222E-02
61 F= -.62983573E+03 E0= -.62981722E+03 d E =-.165262E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629834741411E+03 0.99277E-03 -0.81916E+00 3840 0.669E+00 0.624E-01
DAV: 2 -0.629848973354E+03 -0.14232E-01 -0.16735E-01 4456 0.866E-01 0.347E-01
DAV: 3 -0.629847764361E+03 0.12090E-02 -0.31433E-03 4600 0.150E-01 0.214E-01
DAV: 4 -0.629847368386E+03 0.39598E-03 -0.35478E-03 4448 0.168E-01 0.620E-02
DAV: 5 -0.629847370326E+03 -0.19400E-05 -0.76289E-04 4432 0.705E-02 0.516E-02
DAV: 6 -0.629847359818E+03 0.10508E-04 -0.27135E-04 4424 0.422E-02 0.228E-02
DAV: 7 -0.629847356190E+03 0.36281E-05 -0.23775E-05 2864 0.134E-02
62 F= -.62984736E+03 E0= -.62982883E+03 d E =-.116250E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629846388102E+03 0.97172E-03 -0.16090E+00 3840 0.296E+00 0.276E-01
DAV: 2 -0.629849176966E+03 -0.27889E-02 -0.32890E-02 4456 0.384E-01 0.154E-01
DAV: 3 -0.629848937491E+03 0.23948E-03 -0.62377E-04 4600 0.664E-02 0.945E-02
DAV: 4 -0.629848858878E+03 0.78613E-04 -0.69169E-04 4448 0.742E-02 0.272E-02
DAV: 5 -0.629848859753E+03 -0.87559E-06 -0.15006E-04 4416 0.312E-02 0.229E-02
DAV: 6 -0.629848857600E+03 0.21532E-05 -0.52080E-05 3848 0.186E-02
63 F= -.62984886E+03 E0= -.62983032E+03 d E =-.131264E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629845727202E+03 0.31326E-02 -0.96627E+00 3840 0.728E+00 0.696E-01
DAV: 2 -0.629862503251E+03 -0.16776E-01 -0.19733E-01 4448 0.947E-01 0.374E-01
DAV: 3 -0.629861107084E+03 0.13962E-02 -0.39650E-03 4584 0.164E-01 0.229E-01
DAV: 4 -0.629860580760E+03 0.52632E-03 -0.35856E-03 4480 0.172E-01 0.621E-02
DAV: 5 -0.629860602730E+03 -0.21970E-04 -0.84309E-04 4448 0.743E-02 0.525E-02
DAV: 6 -0.629860590585E+03 0.12145E-04 -0.27336E-04 4416 0.421E-02 0.256E-02
DAV: 7 -0.629860584959E+03 0.56258E-05 -0.22712E-05 2904 0.142E-02
64 F= -.62986058E+03 E0= -.62984205E+03 d E =-.117274E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629860081604E+03 0.50898E-03 -0.77400E-01 3840 0.206E+00 0.197E-01
DAV: 2 -0.629861424707E+03 -0.13431E-02 -0.15863E-02 4448 0.269E-01 0.105E-01
DAV: 3 -0.629861312037E+03 0.11267E-03 -0.32576E-04 4584 0.469E-02 0.643E-02
DAV: 4 -0.629861268405E+03 0.43631E-04 -0.27974E-04 4480 0.486E-02 0.174E-02
DAV: 5 -0.629861270717E+03 -0.23114E-05 -0.68566E-05 4248 0.212E-02
65 F= -.62986127E+03 E0= -.62984273E+03 d E =-.124131E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629856295814E+03 0.49726E-02 -0.97572E+00 3840 0.732E+00 0.690E-01
DAV: 2 -0.629873520428E+03 -0.17225E-01 -0.19928E-01 4424 0.948E-01 0.373E-01
DAV: 3 -0.629872109365E+03 0.14111E-02 -0.37983E-03 4600 0.165E-01 0.228E-01
DAV: 4 -0.629871571104E+03 0.53826E-03 -0.35608E-03 4464 0.174E-01 0.600E-02
DAV: 5 -0.629871598855E+03 -0.27752E-04 -0.89065E-04 4472 0.761E-02 0.534E-02
DAV: 6 -0.629871586137E+03 0.12718E-04 -0.23911E-04 4416 0.395E-02 0.275E-02
DAV: 7 -0.629871580302E+03 0.58349E-05 -0.20130E-05 2920 0.135E-02
66 F= -.62987158E+03 E0= -.62985305E+03 d E =-.103096E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629871212818E+03 0.37332E-03 -0.51140E-01 3856 0.168E+00 0.158E-01
DAV: 2 -0.629872116369E+03 -0.90355E-03 -0.10515E-02 4424 0.218E-01 0.850E-02
DAV: 3 -0.629872040868E+03 0.75502E-04 -0.20717E-04 4600 0.382E-02 0.519E-02
DAV: 4 -0.629872010685E+03 0.30183E-04 -0.18183E-04 4480 0.397E-02 0.137E-02
DAV: 5 -0.629872012415E+03 -0.17303E-05 -0.46876E-05 3712 0.177E-02
67 F= -.62987201E+03 E0= -.62985349E+03 d E =-.107417E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629871216511E+03 0.79417E-03 -0.55931E+00 3840 0.553E+00 0.561E-01
DAV: 2 -0.629881135637E+03 -0.99191E-02 -0.11627E-01 4400 0.726E-01 0.292E-01
DAV: 3 -0.629880216610E+03 0.91903E-03 -0.23249E-03 4592 0.133E-01 0.176E-01
DAV: 4 -0.629879942254E+03 0.27436E-03 -0.23656E-03 4440 0.135E-01 0.504E-02
DAV: 5 -0.629879947170E+03 -0.49158E-05 -0.49305E-04 4392 0.583E-02 0.419E-02
DAV: 6 -0.629879946140E+03 0.10296E-05 -0.17452E-04 4456 0.336E-02 0.196E-02
DAV: 7 -0.629879942653E+03 0.34866E-05 -0.15260E-05 2568 0.121E-02
68 F= -.62987994E+03 E0= -.62986143E+03 d E =-.793024E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629879855334E+03 0.90806E-04 -0.25552E-01 3872 0.118E+00 0.121E-01
DAV: 2 -0.629880308315E+03 -0.45298E-03 -0.53465E-03 4392 0.156E-01 0.620E-02
DAV: 3 -0.629880267035E+03 0.41280E-04 -0.11233E-04 4592 0.288E-02 0.373E-02
DAV: 4 -0.629880254453E+03 0.12582E-04 -0.10169E-04 4472 0.284E-02 0.106E-02
DAV: 5 -0.629880254924E+03 -0.47116E-06 -0.20568E-05 2592 0.122E-02
69 F= -.62988025E+03 E0= -.62986175E+03 d E =-.824251E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629880245640E+03 0.88125E-05 -0.42164E+00 3840 0.482E+00 0.471E-01
DAV: 2 -0.629887807491E+03 -0.75619E-02 -0.88446E-02 4456 0.634E-01 0.260E-01
DAV: 3 -0.629887118741E+03 0.68875E-03 -0.16452E-03 4608 0.112E-01 0.159E-01
DAV: 4 -0.629886916042E+03 0.20270E-03 -0.21279E-03 4472 0.130E-01 0.495E-02
DAV: 5 -0.629886906863E+03 0.91787E-05 -0.43515E-04 4376 0.550E-02 0.419E-02
DAV: 6 -0.629886900180E+03 0.66831E-05 -0.16036E-04 4424 0.320E-02 0.179E-02
DAV: 7 -0.629886897725E+03 0.24544E-05 -0.14925E-05 2592 0.102E-02
70 F= -.62988690E+03 E0= -.62986839E+03 d E =-.664280E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629886835763E+03 0.64417E-04 -0.21713E-01 3856 0.109E+00 0.108E-01
DAV: 2 -0.629887227873E+03 -0.39211E-03 -0.45901E-03 4456 0.145E-01 0.590E-02
DAV: 3 -0.629887192019E+03 0.35854E-04 -0.86322E-05 4608 0.256E-02 0.360E-02
DAV: 4 -0.629887181398E+03 0.10621E-04 -0.10555E-04 4472 0.290E-02 0.108E-02
DAV: 5 -0.629887181028E+03 0.36941E-06 -0.20913E-05 2624 0.124E-02
71 F= -.62988718E+03 E0= -.62986867E+03 d E =-.692610E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629886630458E+03 0.55094E-03 -0.41006E+00 3840 0.476E+00 0.471E-01
DAV: 2 -0.629894071223E+03 -0.74408E-02 -0.86597E-02 4440 0.628E-01 0.249E-01
DAV: 3 -0.629893406471E+03 0.66475E-03 -0.16463E-03 4608 0.113E-01 0.153E-01
DAV: 4 -0.629893194885E+03 0.21159E-03 -0.19171E-03 4464 0.126E-01 0.468E-02
DAV: 5 -0.629893194074E+03 0.81085E-06 -0.41258E-04 4408 0.534E-02 0.392E-02
DAV: 6 -0.629893188553E+03 0.55210E-05 -0.16372E-04 4368 0.332E-02 0.167E-02
DAV: 7 -0.629893186940E+03 0.16129E-05 -0.13999E-05 2576 0.103E-02
72 F= -.62989319E+03 E0= -.62987468E+03 d E =-.600591E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629893061192E+03 0.12736E-03 -0.30512E-01 3840 0.130E+00 0.130E-01
DAV: 2 -0.629893614768E+03 -0.55358E-03 -0.64677E-03 4440 0.172E-01 0.675E-02
DAV: 3 -0.629893565440E+03 0.49328E-04 -0.12577E-04 4608 0.310E-02 0.414E-02
DAV: 4 -0.629893549432E+03 0.16008E-04 -0.13664E-04 4472 0.339E-02 0.124E-02
DAV: 5 -0.629893549547E+03 -0.11456E-06 -0.28579E-05 2760 0.144E-02
73 F= -.62989355E+03 E0= -.62987505E+03 d E =-.636852E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629894593711E+03 -0.10443E-02 -0.30701E+00 3840 0.411E+00 0.385E-01
DAV: 2 -0.629900004749E+03 -0.54110E-02 -0.62558E-02 4400 0.529E-01 0.206E-01
DAV: 3 -0.629899591545E+03 0.41320E-03 -0.11943E-03 4608 0.884E-02 0.126E-01
DAV: 4 -0.629899443471E+03 0.14807E-03 -0.10727E-03 4440 0.942E-02 0.331E-02
DAV: 5 -0.629899453295E+03 -0.98246E-05 -0.25364E-04 4392 0.397E-02 0.283E-02
DAV: 6 -0.629899449727E+03 0.35685E-05 -0.78044E-05 4320 0.228E-02
74 F= -.62989945E+03 E0= -.62988095E+03 d E =-.590018E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629898129398E+03 0.13239E-02 -0.18762E+00 3840 0.321E+00 0.304E-01
DAV: 2 -0.629901455971E+03 -0.33266E-02 -0.38341E-02 4400 0.414E-01 0.161E-01
DAV: 3 -0.629901208074E+03 0.24790E-03 -0.73001E-04 4608 0.688E-02 0.983E-02
DAV: 4 -0.629901119053E+03 0.89021E-04 -0.62538E-04 4440 0.721E-02 0.249E-02
DAV: 5 -0.629901126064E+03 -0.70118E-05 -0.15264E-04 4392 0.307E-02 0.215E-02
DAV: 6 -0.629901124035E+03 0.20299E-05 -0.42680E-05 3872 0.169E-02
75 F= -.62990112E+03 E0= -.62988262E+03 d E =-.757449E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629901018358E+03 0.10771E-03 -0.35207E+00 3840 0.441E+00 0.427E-01
DAV: 2 -0.629907425288E+03 -0.64069E-02 -0.74037E-02 4392 0.577E-01 0.225E-01
DAV: 3 -0.629906907074E+03 0.51821E-03 -0.14286E-03 4616 0.104E-01 0.138E-01
DAV: 4 -0.629906725295E+03 0.18178E-03 -0.13938E-03 4480 0.110E-01 0.390E-02
DAV: 5 -0.629906735175E+03 -0.98807E-05 -0.35294E-04 4464 0.480E-02 0.348E-02
DAV: 6 -0.629906730932E+03 0.42434E-05 -0.89373E-05 4392 0.234E-02
76 F= -.62990673E+03 E0= -.62988822E+03 d E =-.560690E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629906407802E+03 0.32737E-03 -0.55565E-01 3840 0.175E+00 0.175E-01
DAV: 2 -0.629907432266E+03 -0.10245E-02 -0.11777E-02 4400 0.230E-01 0.891E-02
DAV: 3 -0.629907353237E+03 0.79029E-04 -0.22581E-04 4616 0.417E-02 0.542E-02
DAV: 4 -0.629907326484E+03 0.26753E-04 -0.21350E-04 4496 0.443E-02 0.152E-02
DAV: 5 -0.629907328391E+03 -0.19068E-05 -0.57745E-05 4136 0.194E-02
77 F= -.62990733E+03 E0= -.62988882E+03 d E =-.620436E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629905713830E+03 0.16127E-02 -0.41352E+00 3840 0.477E+00 0.451E-01
DAV: 2 -0.629913307105E+03 -0.75933E-02 -0.87291E-02 4400 0.622E-01 0.244E-01
DAV: 3 -0.629912710580E+03 0.59652E-03 -0.16082E-03 4568 0.109E-01 0.150E-01
DAV: 4 -0.629912526458E+03 0.18412E-03 -0.18747E-03 4440 0.124E-01 0.477E-02
DAV: 5 -0.629912525058E+03 0.14003E-05 -0.39900E-04 4400 0.519E-02 0.393E-02
DAV: 6 -0.629912519973E+03 0.50853E-05 -0.14821E-04 4408 0.307E-02 0.161E-02
DAV: 7 -0.629912518271E+03 0.17012E-05 -0.12777E-05 2560 0.951E-03
78 F= -.62991252E+03 E0= -.62989402E+03 d E =-.518988E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629912222432E+03 0.29754E-03 -0.43995E-01 3840 0.156E+00 0.147E-01
DAV: 2 -0.629913028892E+03 -0.80646E-03 -0.92850E-03 4392 0.203E-01 0.792E-02
DAV: 3 -0.629912964880E+03 0.64013E-04 -0.17285E-04 4592 0.353E-02 0.486E-02
DAV: 4 -0.629912944515E+03 0.20364E-04 -0.19001E-04 4448 0.395E-02 0.149E-02
DAV: 5 -0.629912944739E+03 -0.22351E-06 -0.40782E-05 3504 0.167E-02
79 F= -.62991294E+03 E0= -.62989445E+03 d E =-.561635E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629910872931E+03 0.20716E-02 -0.45965E+00 3840 0.502E+00 0.457E-01
DAV: 2 -0.629919305190E+03 -0.84323E-02 -0.96375E-02 4368 0.650E-01 0.253E-01
DAV: 3 -0.629918724892E+03 0.58030E-03 -0.17382E-03 4600 0.110E-01 0.159E-01
DAV: 4 -0.629918538376E+03 0.18652E-03 -0.21381E-03 4432 0.133E-01 0.520E-02
DAV: 5 -0.629918533781E+03 0.45946E-05 -0.44260E-04 4360 0.540E-02 0.440E-02
DAV: 6 -0.629918522255E+03 0.11526E-04 -0.18212E-04 4416 0.346E-02 0.173E-02
DAV: 7 -0.629918520882E+03 0.13733E-05 -0.16803E-05 2560 0.104E-02
80 F= -.62991852E+03 E0= -.62990006E+03 d E =-.557614E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629917603890E+03 0.91836E-03 -0.10084E+00 3840 0.235E+00 0.214E-01
DAV: 2 -0.629919452669E+03 -0.18488E-02 -0.21131E-02 4376 0.305E-01 0.118E-01
DAV: 3 -0.629919323980E+03 0.12869E-03 -0.38036E-04 4600 0.513E-02 0.744E-02
DAV: 4 -0.629919281443E+03 0.42537E-04 -0.45572E-04 4440 0.614E-02 0.236E-02
DAV: 5 -0.629919281184E+03 0.25956E-06 -0.96307E-05 4240 0.251E-02
81 F= -.62991928E+03 E0= -.62990084E+03 d E =-.633644E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629915767611E+03 0.35138E-02 -0.49675E+00 3840 0.522E+00 0.493E-01
DAV: 2 -0.629925079843E+03 -0.93122E-02 -0.10558E-01 4368 0.680E-01 0.260E-01
DAV: 3 -0.629924449108E+03 0.63074E-03 -0.18512E-03 4608 0.113E-01 0.165E-01
DAV: 4 -0.629924238061E+03 0.21105E-03 -0.22554E-03 4456 0.140E-01 0.522E-02
DAV: 5 -0.629924240302E+03 -0.22403E-05 -0.51263E-04 4344 0.571E-02 0.459E-02
DAV: 6 -0.629924226671E+03 0.13631E-04 -0.16725E-04 4424 0.333E-02 0.197E-02
DAV: 7 -0.629924224972E+03 0.16992E-05 -0.18090E-05 2632 0.109E-02
82 F= -.62992422E+03 E0= -.62990580E+03 d E =-.494379E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629923944249E+03 0.28242E-03 -0.30485E-01 3856 0.129E+00 0.121E-01
DAV: 2 -0.629924516735E+03 -0.57249E-03 -0.64747E-03 4360 0.169E-01 0.644E-02
DAV: 3 -0.629924476448E+03 0.40287E-04 -0.11077E-04 4608 0.278E-02 0.407E-02
DAV: 4 -0.629924462700E+03 0.13748E-04 -0.13565E-04 4456 0.342E-02 0.123E-02
DAV: 5 -0.629924463013E+03 -0.31268E-06 -0.30829E-05 3008 0.142E-02
83 F= -.62992446E+03 E0= -.62990604E+03 d E =-.518183E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629920819214E+03 0.36435E-02 -0.49859E+00 3840 0.523E+00 0.484E-01
DAV: 2 -0.629930138881E+03 -0.93197E-02 -0.10513E-01 4392 0.679E-01 0.257E-01
DAV: 3 -0.629929548293E+03 0.59059E-03 -0.19536E-03 4584 0.112E-01 0.162E-01
DAV: 4 -0.629929347778E+03 0.20051E-03 -0.19629E-03 4432 0.129E-01 0.505E-02
DAV: 5 -0.629929352683E+03 -0.49044E-05 -0.43113E-04 4416 0.532E-02 0.418E-02
DAV: 6 -0.629929344784E+03 0.78988E-05 -0.17814E-04 4440 0.348E-02 0.173E-02
DAV: 7 -0.629929343253E+03 0.15312E-05 -0.16764E-05 2584 0.110E-02
84 F= -.62992934E+03 E0= -.62991089E+03 d E =-.488024E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629928775649E+03 0.56914E-03 -0.63696E-01 3840 0.187E+00 0.173E-01
DAV: 2 -0.629929965102E+03 -0.11895E-02 -0.13422E-02 4392 0.243E-01 0.915E-02
DAV: 3 -0.629929889501E+03 0.75601E-04 -0.25023E-04 4584 0.400E-02 0.575E-02
DAV: 4 -0.629929863237E+03 0.26263E-04 -0.23967E-04 4432 0.450E-02 0.174E-02
DAV: 5 -0.629929864402E+03 -0.11653E-05 -0.53835E-05 3976 0.188E-02
85 F= -.62992986E+03 E0= -.62991141E+03 d E =-.540139E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629927800140E+03 0.20631E-02 -0.35192E+00 3840 0.440E+00 0.430E-01
DAV: 2 -0.629934497322E+03 -0.66972E-02 -0.76412E-02 4368 0.580E-01 0.223E-01
DAV: 3 -0.629933995616E+03 0.50171E-03 -0.13793E-03 4528 0.101E-01 0.138E-01
DAV: 4 -0.629933850590E+03 0.14503E-03 -0.16515E-03 4504 0.116E-01 0.449E-02
DAV: 5 -0.629933849908E+03 0.68113E-06 -0.35923E-04 4392 0.485E-02 0.374E-02
DAV: 6 -0.629933845329E+03 0.45791E-05 -0.12192E-04 4400 0.273E-02 0.154E-02
DAV: 7 -0.629933843869E+03 0.14601E-05 -0.10465E-05 2552 0.868E-03
86 F= -.62993384E+03 E0= -.62991542E+03 d E =-.397947E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629933758218E+03 0.87111E-04 -0.12914E-01 3864 0.844E-01 0.826E-02
DAV: 2 -0.629934004051E+03 -0.24583E-03 -0.28143E-03 4368 0.111E-01 0.426E-02
DAV: 3 -0.629933985194E+03 0.18856E-04 -0.51369E-05 4368 0.192E-02 0.262E-02
DAV: 4 -0.629933979511E+03 0.56838E-05 -0.58324E-05 4288 0.220E-02
87 F= -.62993398E+03 E0= -.62991557E+03 d E =-.411511E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629932505080E+03 0.14801E-02 -0.30324E+00 3840 0.409E+00 0.388E-01
DAV: 2 -0.629938200764E+03 -0.56957E-02 -0.64587E-02 4384 0.533E-01 0.212E-01
DAV: 3 -0.629937823197E+03 0.37757E-03 -0.12095E-03 4600 0.939E-02 0.133E-01
DAV: 4 -0.629937723314E+03 0.99882E-04 -0.14285E-03 4440 0.107E-01 0.446E-02
DAV: 5 -0.629937716896E+03 0.64188E-05 -0.28974E-04 4416 0.451E-02 0.354E-02
DAV: 6 -0.629937713322E+03 0.35739E-05 -0.13337E-04 4424 0.294E-02 0.137E-02
DAV: 7 -0.629937712462E+03 0.86020E-06 -0.11118E-05 2560 0.900E-03
88 F= -.62993771E+03 E0= -.62991929E+03 d E =-.373295E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629937533687E+03 0.17964E-03 -0.35773E-01 3840 0.141E+00 0.133E-01
DAV: 2 -0.629938207267E+03 -0.67358E-03 -0.76295E-03 4376 0.183E-01 0.721E-02
DAV: 3 -0.629938162954E+03 0.44312E-04 -0.14268E-04 4600 0.320E-02 0.454E-02
DAV: 4 -0.629938150762E+03 0.12192E-04 -0.16018E-04 4448 0.359E-02 0.147E-02
DAV: 5 -0.629938150303E+03 0.45854E-06 -0.32305E-05 3184 0.153E-02
89 F= -.62993815E+03 E0= -.62991972E+03 d E =-.417079E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629937525358E+03 0.62540E-03 -0.23427E+00 3840 0.360E+00 0.378E-01
DAV: 2 -0.629941955059E+03 -0.44297E-02 -0.50912E-02 4384 0.475E-01 0.181E-01
DAV: 3 -0.629941619161E+03 0.33590E-03 -0.97022E-04 4624 0.823E-02 0.112E-01
DAV: 4 -0.629941519069E+03 0.10009E-03 -0.98098E-04 4448 0.894E-02 0.341E-02
DAV: 5 -0.629941521940E+03 -0.28707E-05 -0.21426E-04 4376 0.376E-02 0.282E-02
DAV: 6 -0.629941520725E+03 0.12151E-05 -0.80384E-05 4280 0.227E-02
90 F= -.62994152E+03 E0= -.62992305E+03 d E =-.337042E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629941456663E+03 0.65277E-04 -0.14254E-01 3840 0.889E-01 0.970E-02
DAV: 2 -0.629941732302E+03 -0.27564E-03 -0.31194E-03 4392 0.117E-01 0.444E-02
DAV: 3 -0.629941713797E+03 0.18505E-04 -0.58058E-05 4608 0.200E-02 0.273E-02
DAV: 4 -0.629941709044E+03 0.47526E-05 -0.52689E-05 4312 0.208E-02
91 F= -.62994171E+03 E0= -.62992323E+03 d E =-.355874E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629941376661E+03 0.33714E-03 -0.20250E+00 3840 0.334E+00 0.308E-01
DAV: 2 -0.629945131071E+03 -0.37544E-02 -0.42343E-02 4352 0.429E-01 0.164E-01
DAV: 3 -0.629944890342E+03 0.24073E-03 -0.75024E-04 4608 0.711E-02 0.104E-01
DAV: 4 -0.629944814161E+03 0.76181E-04 -0.85239E-04 4456 0.860E-02 0.320E-02
DAV: 5 -0.629944817675E+03 -0.35146E-05 -0.20295E-04 4392 0.350E-02 0.283E-02
DAV: 6 -0.629944812710E+03 0.49657E-05 -0.59029E-05 4096 0.193E-02
92 F= -.62994481E+03 E0= -.62992633E+03 d E =-.310367E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629944180239E+03 0.63744E-03 -0.90265E-01 3840 0.223E+00 0.207E-01
DAV: 2 -0.629945874080E+03 -0.16938E-02 -0.18984E-02 4352 0.288E-01 0.110E-01
DAV: 3 -0.629945769024E+03 0.10506E-03 -0.32941E-04 4608 0.473E-02 0.691E-02
DAV: 4 -0.629945736724E+03 0.32300E-04 -0.37194E-04 4456 0.569E-02 0.208E-02
DAV: 5 -0.629945738528E+03 -0.18034E-05 -0.90222E-05 4232 0.233E-02
93 F= -.62994574E+03 E0= -.62992726E+03 d E =-.402948E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629945547885E+03 0.18884E-03 -0.19754E+00 3840 0.332E+00 0.321E-01
DAV: 2 -0.629949441562E+03 -0.38937E-02 -0.43686E-02 4384 0.439E-01 0.169E-01
DAV: 3 -0.629949178196E+03 0.26337E-03 -0.76388E-04 4608 0.755E-02 0.106E-01
DAV: 4 -0.629949109210E+03 0.68986E-04 -0.98377E-04 4504 0.901E-02 0.364E-02
DAV: 5 -0.629949105110E+03 0.40999E-05 -0.20546E-04 4368 0.375E-02 0.300E-02
DAV: 6 -0.629949101658E+03 0.34512E-05 -0.83588E-05 4264 0.229E-02
94 F= -.62994910E+03 E0= -.62993062E+03 d E =-.336313E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.629948970465E+03 0.13464E-03 -0.26431E-01 3840 0.121E+00 0.119E-01
DAV: 2 -0.629949500072E+03 -0.52961E-03 -0.58723E-03 4384 0.161E-01 0.617E-02
DAV: 3 -0.629949466540E+03 0.33532E-04 -0.99710E-05 4608 0.272E-02 0.385E-02