iterations/neb0_image09_iter73_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 0.149742194540E+04 0.14974E+04 -0.44534E+04 330 0.697E+02
DAV: 2 0.254389223145E+03 -0.12430E+04 -0.11661E+04 417 0.165E+02
DAV: 3 -0.352081439317E+03 -0.60647E+03 -0.60211E+03 345 0.117E+02
DAV: 4 -0.426731587752E+03 -0.74650E+02 -0.74275E+02 309 0.526E+01
DAV: 5 -0.428393616983E+03 -0.16620E+01 -0.16584E+01 318 0.810E+00 0.462E+01
DAV: 6 -0.373310803775E+03 0.55083E+02 -0.16453E+02 300 0.315E+01 0.227E+01
DAV: 7 -0.369096319023E+03 0.42145E+01 -0.18209E+01 327 0.100E+01 0.114E+01
DAV: 8 -0.367530790019E+03 0.15655E+01 -0.35556E+00 327 0.484E+00 0.486E+00
DAV: 9 -0.366850860627E+03 0.67993E+00 -0.87830E-01 327 0.261E+00 0.117E+00
DAV: 10 -0.366765593322E+03 0.85267E-01 -0.21906E-01 318 0.114E+00 0.831E-01
DAV: 11 -0.366729071192E+03 0.36522E-01 -0.34815E-02 318 0.477E-01 0.504E-01
DAV: 12 -0.366692385935E+03 0.36685E-01 -0.27433E-02 309 0.452E-01 0.270E-01
DAV: 13 -0.366685172938E+03 0.72130E-02 -0.17740E-02 336 0.383E-01 0.196E-01
DAV: 14 -0.366685861912E+03 -0.68897E-03 -0.92679E-03 309 0.345E-01 0.149E-01
DAV: 15 -0.366699847109E+03 -0.13985E-01 -0.72404E-03 309 0.266E-01 0.823E-02
DAV: 16 -0.366709255696E+03 -0.94086E-02 -0.40589E-03 300 0.187E-01 0.569E-02
DAV: 17 -0.366717576992E+03 -0.83213E-02 -0.97878E-04 336 0.799E-02 0.532E-02
DAV: 18 -0.366726955825E+03 -0.93788E-02 -0.59050E-04 300 0.518E-02 0.253E-02
DAV: 19 -0.366731627686E+03 -0.46719E-02 -0.21311E-04 327 0.286E-02 0.188E-02
DAV: 20 -0.366734798227E+03 -0.31705E-02 -0.19267E-04 309 0.306E-02 0.110E-02
DAV: 21 -0.366736326356E+03 -0.15281E-02 -0.54598E-05 300 0.167E-02 0.712E-03
DAV: 22 -0.366737620158E+03 -0.12938E-02 -0.74088E-05 282 0.174E-02 0.580E-03
DAV: 23 -0.366737969002E+03 -0.34884E-03 -0.93424E-06 228 0.732E-03 0.347E-03
DAV: 24 -0.366738231266E+03 -0.26226E-03 -0.16183E-05 237 0.884E-03 0.382E-03
DAV: 25 -0.366738311385E+03 -0.80119E-04 -0.16005E-06 228 0.428E-03 0.265E-03
DAV: 26 -0.366738397734E+03 -0.86350E-04 -0.46839E-06 192 0.607E-03 0.141E-03
DAV: 27 -0.366738427153E+03 -0.29419E-04 -0.13425E-06 219 0.286E-03 0.153E-03
DAV: 28 -0.366738441469E+03 -0.14316E-04 -0.56666E-07 219 0.164E-03 0.110E-03
DAV: 29 -0.366738453797E+03 -0.12328E-04 -0.84547E-07 210 0.271E-03 0.773E-04
DAV: 30 -0.366738459902E+03 -0.61045E-05 -0.31173E-07 219 0.131E-03
1 F= -.36673846E+03 E0= -.36674703E+03 d E =0.257238E-01