iterations/neb0_image04_iter40_OSZICAR.out output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
N E dE d eps ncg rms rms(c)
DAV: 1 0.140995179741E+04 0.14100E+04 -0.43939E+04 330 0.697E+02
DAV: 2 0.235207020973E+03 -0.11747E+04 -0.11029E+04 417 0.161E+02
DAV: 3 -0.335028232822E+03 -0.57024E+03 -0.56457E+03 381 0.113E+02
DAV: 4 -0.401788568533E+03 -0.66760E+02 -0.66096E+02 309 0.457E+01
DAV: 5 -0.403446539400E+03 -0.16580E+01 -0.16518E+01 318 0.743E+00 0.407E+01
DAV: 6 -0.361932424178E+03 0.41514E+02 -0.14860E+02 300 0.280E+01 0.203E+01
DAV: 7 -0.358789115227E+03 0.31433E+01 -0.14782E+01 363 0.901E+00 0.106E+01
DAV: 8 -0.357662300681E+03 0.11268E+01 -0.89309E+00 327 0.445E+00 0.574E+00
DAV: 9 -0.356879382042E+03 0.78292E+00 -0.21843E+00 327 0.251E+00 0.183E+00
DAV: 10 -0.356731074486E+03 0.14831E+00 -0.28779E-01 318 0.126E+00 0.892E-01
DAV: 11 -0.356693086895E+03 0.37988E-01 -0.54990E-02 345 0.600E-01 0.575E-01
DAV: 12 -0.356667309575E+03 0.25777E-01 -0.22018E-02 336 0.421E-01 0.297E-01
DAV: 13 -0.356658593121E+03 0.87165E-02 -0.14230E-02 309 0.350E-01 0.183E-01
DAV: 14 -0.356667857226E+03 -0.92641E-02 -0.15846E-02 318 0.303E-01 0.175E-01
DAV: 15 -0.356679180104E+03 -0.11323E-01 -0.89905E-03 309 0.200E-01 0.119E-01
DAV: 16 -0.356688108859E+03 -0.89288E-02 -0.56961E-03 318 0.148E-01 0.593E-02
DAV: 17 -0.356695185555E+03 -0.70767E-02 -0.14667E-03 327 0.934E-02 0.444E-02
DAV: 18 -0.356702284012E+03 -0.70985E-02 -0.57360E-04 336 0.572E-02 0.278E-02
DAV: 19 -0.356711206903E+03 -0.89229E-02 -0.66855E-04 291 0.461E-02 0.173E-02
DAV: 20 -0.356712954352E+03 -0.17474E-02 -0.81812E-05 336 0.164E-02 0.125E-02
DAV: 21 -0.356715076413E+03 -0.21221E-02 -0.10883E-04 282 0.185E-02 0.743E-03
DAV: 22 -0.356716234635E+03 -0.11582E-02 -0.54233E-05 291 0.118E-02 0.529E-03
DAV: 23 -0.356716809050E+03 -0.57442E-03 -0.23928E-05 255 0.101E-02 0.274E-03
DAV: 24 -0.356717025855E+03 -0.21681E-03 -0.61740E-06 237 0.505E-03 0.239E-03
DAV: 25 -0.356717177586E+03 -0.15173E-03 -0.45010E-06 228 0.445E-03 0.146E-03
DAV: 26 -0.356717273344E+03 -0.95758E-04 -0.34943E-06 219 0.334E-03 0.134E-03
DAV: 27 -0.356717312576E+03 -0.39232E-04 -0.16117E-06 228 0.267E-03 0.610E-04
DAV: 28 -0.356717331686E+03 -0.19110E-04 -0.94460E-07 228 0.182E-03 0.593E-04
DAV: 29 -0.356717343707E+03 -0.12021E-04 -0.48863E-07 219 0.143E-03 0.208E-04
DAV: 30 -0.356717349854E+03 -0.61475E-05 -0.32678E-07 219 0.983E-04
1 F= -.35671735E+03 E0= -.35672243E+03 d E =0.152265E-01