./iterations/neb0_image02_iter7_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 0.144811868100E+04 0.14481E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224486151548E+03 -0.12236E+04 -0.11470E+04 435 0.163E+02
DAV: 3 -0.362867494271E+03 -0.58735E+03 -0.58423E+03 345 0.114E+02
DAV: 4 -0.433468365284E+03 -0.70601E+02 -0.70364E+02 309 0.508E+01
DAV: 5 -0.435052500538E+03 -0.15841E+01 -0.15816E+01 318 0.781E+00 0.426E+01
DAV: 6 -0.389084037892E+03 0.45968E+02 -0.14802E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385611140731E+03 0.34729E+01 -0.13197E+01 345 0.777E+00 0.104E+01
DAV: 8 -0.384138569329E+03 0.14726E+01 -0.19674E+00 327 0.379E+00 0.429E+00
DAV: 9 -0.383588189882E+03 0.55038E+00 -0.10797E+00 336 0.217E+00 0.102E+00
DAV: 10 -0.383523390658E+03 0.64799E-01 -0.12389E-01 318 0.911E-01 0.842E-01
DAV: 11 -0.383495061442E+03 0.28329E-01 -0.85310E-02 336 0.659E-01 0.856E-01
DAV: 12 -0.383471477271E+03 0.23584E-01 -0.64931E-02 327 0.418E-01 0.436E-01
DAV: 13 -0.383468107651E+03 0.33696E-02 -0.15207E-01 345 0.507E-01 0.906E-01
DAV: 14 -0.383452277936E+03 0.15830E-01 -0.20305E-02 345 0.407E-01 0.317E-01
DAV: 15 -0.383456539797E+03 -0.42619E-02 -0.12421E-02 336 0.304E-01 0.345E-01
DAV: 16 -0.383459985331E+03 -0.34455E-02 -0.53382E-03 300 0.203E-01 0.304E-01
DAV: 17 -0.383464252758E+03 -0.42674E-02 -0.33297E-03 300 0.187E-01 0.157E-01
DAV: 18 -0.383473734274E+03 -0.94815E-02 -0.16453E-03 300 0.133E-01 0.119E-01
DAV: 19 -0.383485105526E+03 -0.11371E-01 -0.19007E-03 327 0.145E-01 0.699E-02
DAV: 20 -0.383492684096E+03 -0.75786E-02 -0.10763E-03 318 0.893E-02 0.566E-02
DAV: 21 -0.383497930633E+03 -0.52465E-02 -0.42867E-04 345 0.478E-02 0.733E-02
DAV: 22 -0.383502101082E+03 -0.41704E-02 -0.25154E-04 282 0.359E-02 0.219E-02
DAV: 23 -0.383505530174E+03 -0.34291E-02 -0.20080E-04 309 0.263E-02 0.160E-02
DAV: 24 -0.383506483729E+03 -0.95355E-03 -0.24379E-05 273 0.108E-02 0.144E-02
DAV: 25 -0.383507927201E+03 -0.14435E-02 -0.73736E-05 300 0.157E-02 0.112E-02
DAV: 26 -0.383508367942E+03 -0.44074E-03 -0.11310E-05 237 0.776E-03 0.533E-03
DAV: 27 -0.383508711331E+03 -0.34339E-03 -0.14234E-05 228 0.738E-03 0.551E-03
DAV: 28 -0.383508845324E+03 -0.13399E-03 -0.40638E-06 228 0.404E-03 0.277E-03
DAV: 29 -0.383508933022E+03 -0.87697E-04 -0.24593E-06 228 0.311E-03 0.274E-03
DAV: 30 -0.383508990830E+03 -0.57808E-04 -0.19273E-06 201 0.257E-03 0.195E-03
DAV: 31 -0.383509019626E+03 -0.28796E-04 -0.10336E-06 219 0.205E-03 0.121E-03
DAV: 32 -0.383509032593E+03 -0.12967E-04 -0.69214E-07 201 0.174E-03 0.107E-03
DAV: 33 -0.383509038618E+03 -0.60254E-05 -0.29574E-07 228 0.106E-03
1 F= -.38350904E+03 E0= -.38352558E+03 d E =0.496128E-01