./iterations/neb0_image07_iter284_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.375645106090E+03 0.37565E+03 -0.14288E+04 624 0.799E+02
DAV: 2 0.501284270272E+01 -0.37063E+03 -0.35926E+03 861 0.195E+02
DAV: 3 -0.963721362431E+02 -0.10138E+03 -0.10107E+03 656 0.117E+02
DAV: 4 -0.101229243969E+03 -0.48571E+01 -0.48457E+01 712 0.299E+01
DAV: 5 -0.101326240415E+03 -0.96996E-01 -0.96958E-01 736 0.379E+00 0.228E+01
DAV: 6 -0.926316472051E+02 0.86946E+01 -0.31007E+01 712 0.301E+01 0.119E+01
DAV: 7 -0.917526374793E+02 0.87901E+00 -0.17085E+00 728 0.614E+00 0.479E+00
DAV: 8 -0.913727931194E+02 0.37984E+00 -0.54499E-01 736 0.396E+00 0.161E+00
DAV: 9 -0.912889193622E+02 0.83874E-01 -0.12748E-01 736 0.152E+00 0.423E-01
DAV: 10 -0.912791640101E+02 0.97554E-02 -0.43751E-02 728 0.106E+00 0.296E-01
DAV: 11 -0.912841200850E+02 -0.49561E-02 -0.12983E-02 613 0.583E-01 0.155E-01
DAV: 12 -0.912872435033E+02 -0.31234E-02 -0.29850E-03 612 0.231E-01 0.107E-01
DAV: 13 -0.912912261824E+02 -0.39827E-02 -0.23513E-03 662 0.253E-01 0.542E-02
DAV: 14 -0.912947110531E+02 -0.34849E-02 -0.97041E-04 669 0.189E-01 0.328E-02
DAV: 15 -0.912961275365E+02 -0.14165E-02 -0.21042E-04 672 0.787E-02 0.227E-02
DAV: 16 -0.912968705957E+02 -0.74306E-03 -0.13400E-04 760 0.743E-02 0.102E-02
DAV: 17 -0.912975558822E+02 -0.68529E-03 -0.68989E-05 631 0.341E-02 0.126E-02
DAV: 18 -0.912977130866E+02 -0.15720E-03 -0.91633E-06 496 0.162E-02 0.810E-03
DAV: 19 -0.912978621585E+02 -0.14907E-03 -0.44939E-05 609 0.362E-02 0.611E-03
DAV: 20 -0.912978708254E+02 -0.86669E-05 -0.35314E-06 528 0.147E-02
1 F= -.91297871E+02 E0= -.91302487E+02 d E =0.138496E-01