./iterations/neb0_image02_iter11_OSZICAR.out output for 3: 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
running
N E dE d eps ncg rms rms(c)
DAV: 1 0.144808653611E+04 0.14481E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224473160564E+03 -0.12236E+04 -0.11470E+04 435 0.163E+02
DAV: 3 -0.362863960665E+03 -0.58734E+03 -0.58421E+03 345 0.114E+02
DAV: 4 -0.433463147996E+03 -0.70599E+02 -0.70362E+02 309 0.508E+01
DAV: 5 -0.435047204063E+03 -0.15841E+01 -0.15815E+01 318 0.781E+00 0.426E+01
DAV: 6 -0.389084689689E+03 0.45963E+02 -0.14801E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385615032065E+03 0.34697E+01 -0.13306E+01 345 0.778E+00 0.104E+01
DAV: 8 -0.384138228569E+03 0.14768E+01 -0.20323E+00 327 0.380E+00 0.428E+00
DAV: 9 -0.383582585275E+03 0.55564E+00 -0.62925E-01 336 0.213E+00 0.129E+00
DAV: 10 -0.383529302151E+03 0.53283E-01 -0.53423E-01 327 0.102E+00 0.116E+00
DAV: 11 -0.383508233265E+03 0.21069E-01 -0.13188E-01 318 0.672E-01 0.112E+00
DAV: 12 -0.383479764708E+03 0.28469E-01 -0.28969E-02 327 0.457E-01 0.643E-01
DAV: 13 -0.383467676055E+03 0.12089E-01 -0.13906E-02 318 0.369E-01 0.437E-01
DAV: 14 -0.383453747951E+03 0.13928E-01 -0.25148E-02 309 0.429E-01 0.399E-01
DAV: 15 -0.383453299882E+03 0.44807E-03 -0.82542E-03 345 0.302E-01 0.210E-01
DAV: 16 -0.383459969121E+03 -0.66692E-02 -0.62757E-03 291 0.239E-01 0.153E-01
DAV: 17 -0.383470262426E+03 -0.10293E-01 -0.28743E-03 309 0.184E-01 0.905E-02
DAV: 18 -0.383480353095E+03 -0.10091E-01 -0.24831E-03 300 0.157E-01 0.101E-01
DAV: 19 -0.383490103682E+03 -0.97506E-02 -0.13032E-03 336 0.108E-01 0.499E-02
DAV: 20 -0.383495751889E+03 -0.56482E-02 -0.34619E-04 327 0.514E-02 0.418E-02
DAV: 21 -0.383501112866E+03 -0.53610E-02 -0.25349E-04 309 0.359E-02 0.208E-02
DAV: 22 -0.383504793899E+03 -0.36810E-02 -0.15654E-04 300 0.255E-02 0.138E-02
DAV: 23 -0.383507750532E+03 -0.29566E-02 -0.17072E-04 300 0.227E-02 0.107E-02
DAV: 24 -0.383508688808E+03 -0.93828E-03 -0.29953E-05 282 0.114E-02 0.563E-03
DAV: 25 -0.383509472123E+03 -0.78332E-03 -0.41444E-05 282 0.124E-02 0.450E-03
DAV: 26 -0.383509652285E+03 -0.18016E-03 -0.33516E-06 237 0.511E-03 0.329E-03
DAV: 27 -0.383509796188E+03 -0.14390E-03 -0.78028E-06 201 0.708E-03 0.325E-03
DAV: 28 -0.383509862343E+03 -0.66155E-04 -0.18249E-06 228 0.432E-03 0.201E-03
DAV: 29 -0.383509906860E+03 -0.44517E-04 -0.27201E-06 192 0.441E-03 0.139E-03
DAV: 30 -0.383509935470E+03 -0.28611E-04 -0.10724E-06 219 0.244E-03 0.105E-03
DAV: 31 -0.383509947381E+03 -0.11911E-04 -0.65895E-07 219 0.168E-03 0.555E-04
DAV: 32 -0.383509952537E+03 -0.51555E-05 -0.22281E-07 219 0.944E-04
1 F= -.38350995E+03 E0= -.38352650E+03 d E =0.496502E-01