iterations/neb0_image09_iter10_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 0.209803974092E+04 0.20980E+04 -0.11612E+05 1704 0.105E+03
DAV: 2 -0.142103383451E+03 -0.22401E+04 -0.21507E+04 2152 0.262E+02
DAV: 3 -0.466104772130E+03 -0.32400E+03 -0.32061E+03 1832 0.108E+02
DAV: 4 -0.478969271208E+03 -0.12864E+02 -0.12815E+02 1984 0.228E+01
DAV: 5 -0.479416937014E+03 -0.44767E+00 -0.44743E+00 2136 0.374E+00 0.427E+01
DAV: 6 -0.447316498329E+03 0.32100E+02 -0.14333E+02 2008 0.310E+01 0.270E+01
DAV: 7 -0.448565276437E+03 -0.12488E+01 -0.65273E+01 1888 0.111E+01 0.136E+01
DAV: 8 -0.446569981043E+03 0.19953E+01 -0.77134E+00 2496 0.805E+00 0.998E+00
DAV: 9 -0.446761264898E+03 -0.19128E+00 -0.20074E+01 2056 0.460E+00 0.554E+00
DAV: 10 -0.445862539048E+03 0.89873E+00 -0.93716E-01 2232 0.424E+00 0.330E+00
DAV: 11 -0.445882325801E+03 -0.19787E-01 -0.17726E+00 1904 0.170E+00 0.317E+00
DAV: 12 -0.445848891957E+03 0.33434E-01 -0.13387E+00 1968 0.101E+00 0.256E+00
DAV: 13 -0.445884721060E+03 -0.35829E-01 -0.12101E+00 2160 0.807E-01 0.331E+00
DAV: 14 -0.445812213020E+03 0.72508E-01 -0.40640E-01 2032 0.642E-01 0.332E-01
DAV: 15 -0.445831387748E+03 -0.19175E-01 -0.51376E-02 1976 0.357E-01 0.138E+00
DAV: 16 -0.445820640699E+03 0.10747E-01 -0.24000E-02 1832 0.205E-01 0.363E-01
DAV: 17 -0.445822969265E+03 -0.23286E-02 -0.30864E-03 1920 0.109E-01 0.134E-01
DAV: 18 -0.445826059996E+03 -0.30907E-02 -0.14002E-03 1920 0.743E-02 0.197E-01
DAV: 19 -0.445827946358E+03 -0.18864E-02 -0.51008E-04 1912 0.749E-02 0.166E-01
DAV: 20 -0.445829686610E+03 -0.17403E-02 -0.11651E-03 2080 0.805E-02 0.834E-02
DAV: 21 -0.445830692413E+03 -0.10058E-02 -0.27348E-04 1816 0.381E-02 0.255E-02
DAV: 22 -0.445831448827E+03 -0.75641E-03 -0.19586E-04 1832 0.292E-02 0.714E-02
DAV: 23 -0.445831748187E+03 -0.29936E-03 -0.23177E-04 1848 0.252E-02 0.883E-02
DAV: 24 -0.445831852377E+03 -0.10419E-03 -0.10201E-04 1592 0.227E-02 0.892E-03
DAV: 25 -0.445831964239E+03 -0.11186E-03 -0.21728E-05 1312 0.106E-02 0.761E-03
DAV: 26 -0.445832017659E+03 -0.53419E-04 -0.61562E-06 1040 0.838E-03 0.723E-03
DAV: 27 -0.445832058443E+03 -0.40784E-04 -0.66060E-06 1064 0.603E-03 0.729E-03
DAV: 28 -0.445832076760E+03 -0.18317E-04 -0.19183E-06 952 0.362E-03 0.415E-03
DAV: 29 -0.445832097254E+03 -0.20494E-04 -0.30155E-06 1016 0.444E-03 0.486E-03
DAV: 30 -0.445832101248E+03 -0.39933E-05 -0.59429E-07 936 0.256E-03
1 F= -.44583210E+03 E0= -.44580748E+03 d E =-.738600E-01