./iterations/neb0_image07_iter182_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 0.371339501062E+03 0.37134E+03 -0.14323E+04 632 0.799E+02
DAV: 2 0.324857182710E+01 -0.36809E+03 -0.35545E+03 869 0.194E+02
DAV: 3 -0.964073848718E+02 -0.99656E+02 -0.99335E+02 672 0.116E+02
DAV: 4 -0.101066796418E+03 -0.46594E+01 -0.46474E+01 696 0.287E+01
DAV: 5 -0.101162373896E+03 -0.95577E-01 -0.95513E-01 736 0.368E+00 0.226E+01
DAV: 6 -0.925714218908E+02 0.85910E+01 -0.30503E+01 736 0.299E+01 0.119E+01
DAV: 7 -0.917157275871E+02 0.85569E+00 -0.17279E+00 720 0.615E+00 0.479E+00
DAV: 8 -0.913443424291E+02 0.37139E+00 -0.52802E-01 728 0.395E+00 0.163E+00
DAV: 9 -0.912629091520E+02 0.81433E-01 -0.13145E-01 728 0.158E+00 0.420E-01
DAV: 10 -0.912544896415E+02 0.84195E-02 -0.42222E-02 749 0.108E+00 0.294E-01
DAV: 11 -0.912587170702E+02 -0.42274E-02 -0.11703E-02 616 0.571E-01 0.137E-01
DAV: 12 -0.912615916005E+02 -0.28745E-02 -0.25487E-03 639 0.259E-01 0.932E-02
DAV: 13 -0.912654602824E+02 -0.38687E-02 -0.14176E-03 623 0.191E-01 0.516E-02
DAV: 14 -0.912683512711E+02 -0.28910E-02 -0.58341E-04 757 0.182E-01 0.346E-02
DAV: 15 -0.912700847394E+02 -0.17335E-02 -0.32417E-04 661 0.999E-02 0.328E-02
DAV: 16 -0.912711336429E+02 -0.10489E-02 -0.16346E-04 741 0.732E-02 0.140E-02
DAV: 17 -0.912719016149E+02 -0.76797E-03 -0.91942E-05 674 0.465E-02 0.122E-02
DAV: 18 -0.912721508312E+02 -0.24922E-03 -0.28240E-05 600 0.342E-02 0.735E-03
DAV: 19 -0.912722758849E+02 -0.12505E-03 -0.16400E-05 428 0.199E-02 0.420E-03
DAV: 20 -0.912722884639E+02 -0.12579E-04 -0.40254E-06 528 0.124E-02 0.204E-03
DAV: 21 -0.912723150316E+02 -0.26568E-04 -0.40540E-06 403 0.107E-02 0.144E-03
DAV: 22 -0.912723229501E+02 -0.79185E-05 -0.14700E-06 461 0.495E-03
1 F= -.91272323E+02 E0= -.91277963E+02 d E =0.169187E-01