./iterations/neb0_image09_iter53_OSZICAR.out output for 39: 512-->524:: F2 + Si-NH-Si on surface slat V5 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.209695418821E+04 0.20970E+04 -0.11611E+05 1704 0.105E+03
DAV: 2 -0.142930767569E+03 -0.22399E+04 -0.21498E+04 2160 0.262E+02
DAV: 3 -0.466459287787E+03 -0.32353E+03 -0.32019E+03 1840 0.108E+02
DAV: 4 -0.479209431706E+03 -0.12750E+02 -0.12702E+02 1960 0.227E+01
DAV: 5 -0.479668861622E+03 -0.45943E+00 -0.45919E+00 2104 0.379E+00 0.427E+01
DAV: 6 -0.447160158091E+03 0.32509E+02 -0.14257E+02 2016 0.308E+01 0.271E+01
DAV: 7 -0.449090956517E+03 -0.19308E+01 -0.75282E+01 1920 0.111E+01 0.137E+01
DAV: 8 -0.446258427097E+03 0.28325E+01 -0.82046E+00 2408 0.798E+00 0.858E+00
DAV: 9 -0.446817643060E+03 -0.55922E+00 -0.14639E+01 1888 0.392E+00 0.485E+00
DAV: 10 -0.446015628773E+03 0.80201E+00 -0.64264E-01 2160 0.388E+00 0.339E+00
DAV: 11 -0.446142758960E+03 -0.12713E+00 -0.26054E+00 1928 0.167E+00 0.417E+00
DAV: 12 -0.446015002452E+03 0.12776E+00 -0.20434E+00 2000 0.132E+00 0.303E+00
DAV: 13 -0.446046128807E+03 -0.31126E-01 -0.14912E+00 2136 0.928E-01 0.337E+00
DAV: 14 -0.445967286585E+03 0.78842E-01 -0.43352E-01 1984 0.655E-01 0.461E-01
DAV: 15 -0.445976407086E+03 -0.91205E-02 -0.17409E-02 1960 0.255E-01 0.569E-01
DAV: 16 -0.445976148452E+03 0.25863E-03 -0.73149E-03 1896 0.152E-01 0.171E-01
DAV: 17 -0.445978162310E+03 -0.20139E-02 -0.21866E-03 1880 0.928E-02 0.117E-01
DAV: 18 -0.445981777070E+03 -0.36148E-02 -0.74631E-03 2016 0.810E-02 0.446E-01
DAV: 19 -0.445983354984E+03 -0.15779E-02 -0.12606E-02 2224 0.124E-01 0.348E-01
DAV: 20 -0.445984531557E+03 -0.11766E-02 -0.94318E-04 1840 0.558E-02 0.102E-01
DAV: 21 -0.445985568439E+03 -0.10369E-02 -0.55919E-04 1872 0.491E-02 0.422E-02
DAV: 22 -0.445986105620E+03 -0.53718E-03 -0.16924E-04 1832 0.300E-02 0.503E-02
DAV: 23 -0.445986335805E+03 -0.23019E-03 -0.39024E-05 1552 0.155E-02 0.618E-02
DAV: 24 -0.445986475936E+03 -0.14013E-03 -0.99060E-05 1648 0.187E-02 0.246E-02
DAV: 25 -0.445986598764E+03 -0.12283E-03 -0.30090E-05 1160 0.982E-03 0.190E-02
DAV: 26 -0.445986696717E+03 -0.97954E-04 -0.12723E-05 1176 0.579E-03 0.828E-03
DAV: 27 -0.445986726622E+03 -0.29904E-04 -0.21567E-06 968 0.386E-03 0.368E-03
DAV: 28 -0.445986756227E+03 -0.29605E-04 -0.22185E-06 1056 0.342E-03 0.140E-03
DAV: 29 -0.445986763760E+03 -0.75333E-05 -0.44091E-07 936 0.158E-03
1 F= -.44598676E+03 E0= -.44596061E+03 d E =-.784474E-01