iterations/neb0_image06_iter30_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 0.144980875402E+04 0.14498E+04 -0.44219E+04 330 0.697E+02
DAV: 2 0.231284843053E+03 -0.12185E+04 -0.11426E+04 417 0.163E+02
DAV: 3 -0.365115703497E+03 -0.59640E+03 -0.59311E+03 354 0.114E+02
DAV: 4 -0.433163902955E+03 -0.68048E+02 -0.67807E+02 309 0.493E+01
DAV: 5 -0.434675440842E+03 -0.15115E+01 -0.15087E+01 327 0.762E+00 0.426E+01
DAV: 6 -0.388901934290E+03 0.45774E+02 -0.14827E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385475920304E+03 0.34260E+01 -0.13176E+01 345 0.776E+00 0.104E+01
DAV: 8 -0.383997639020E+03 0.14783E+01 -0.18077E+00 327 0.378E+00 0.428E+00
DAV: 9 -0.383466824463E+03 0.53081E+00 -0.11866E+00 336 0.214E+00 0.105E+00
DAV: 10 -0.383400930230E+03 0.65894E-01 -0.11228E-01 336 0.911E-01 0.870E-01
DAV: 11 -0.383367397425E+03 0.33533E-01 -0.14382E-01 345 0.705E-01 0.793E-01
DAV: 12 -0.383346169451E+03 0.21228E-01 -0.59169E-02 327 0.498E-01 0.748E-01
DAV: 13 -0.383337681768E+03 0.84877E-02 -0.13064E-01 372 0.468E-01 0.536E-01
DAV: 14 -0.383329440212E+03 0.82416E-02 -0.22364E-02 309 0.417E-01 0.588E-01
DAV: 15 -0.383328289142E+03 0.11511E-02 -0.10268E-02 327 0.264E-01 0.627E-01
DAV: 16 -0.383328118917E+03 0.17022E-03 -0.45553E-02 309 0.292E-01 0.215E-01
DAV: 17 -0.383337064757E+03 -0.89458E-02 -0.51781E-03 327 0.237E-01 0.134E-01
DAV: 18 -0.383349928322E+03 -0.12864E-01 -0.27851E-03 300 0.182E-01 0.827E-02
DAV: 19 -0.383359524390E+03 -0.95961E-02 -0.18987E-03 327 0.131E-01 0.582E-02
DAV: 20 -0.383364799969E+03 -0.52756E-02 -0.44859E-04 327 0.554E-02 0.442E-02
DAV: 21 -0.383369654694E+03 -0.48547E-02 -0.22938E-04 318 0.317E-02 0.514E-02
DAV: 22 -0.383374995493E+03 -0.53408E-02 -0.53529E-04 309 0.395E-02 0.318E-02
DAV: 23 -0.383377045845E+03 -0.20504E-02 -0.12588E-04 318 0.246E-02 0.341E-02
DAV: 24 -0.383378001415E+03 -0.95557E-03 -0.10430E-04 300 0.178E-02 0.170E-02
DAV: 25 -0.383378686494E+03 -0.68508E-03 -0.24267E-05 255 0.115E-02 0.563E-03
DAV: 26 -0.383379384932E+03 -0.69844E-03 -0.35354E-05 264 0.107E-02 0.658E-03
DAV: 27 -0.383379621611E+03 -0.23668E-03 -0.63149E-06 228 0.573E-03 0.438E-03
DAV: 28 -0.383379724842E+03 -0.10323E-03 -0.37334E-06 219 0.369E-03 0.360E-03
DAV: 29 -0.383379800968E+03 -0.76126E-04 -0.25975E-06 210 0.320E-03 0.236E-03
DAV: 30 -0.383379852048E+03 -0.51080E-04 -0.19530E-06 210 0.286E-03 0.129E-03
DAV: 31 -0.383379878672E+03 -0.26624E-04 -0.10835E-06 210 0.204E-03 0.809E-04
DAV: 32 -0.383379893437E+03 -0.14765E-04 -0.63038E-07 228 0.159E-03 0.124E-03
DAV: 33 -0.383379902222E+03 -0.87852E-05 -0.35783E-07 210 0.106E-03
1 F= -.38337990E+03 E0= -.38339685E+03 d E =0.508447E-01