./iterations/neb0_image06_iter165_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 0.371014241519E+03 0.37101E+03 -0.14343E+04 640 0.799E+02
DAV: 2 0.352913950700E+01 -0.36749E+03 -0.35583E+03 877 0.193E+02
DAV: 3 -0.958895411463E+02 -0.99419E+02 -0.99086E+02 674 0.116E+02
DAV: 4 -0.100489708779E+03 -0.46002E+01 -0.45875E+01 704 0.285E+01
DAV: 5 -0.100580713135E+03 -0.91004E-01 -0.90953E-01 736 0.360E+00 0.226E+01
DAV: 6 -0.920002252277E+02 0.85805E+01 -0.30804E+01 717 0.304E+01 0.118E+01
DAV: 7 -0.911830245357E+02 0.81720E+00 -0.17215E+00 720 0.626E+00 0.480E+00
DAV: 8 -0.908095748817E+02 0.37345E+00 -0.52723E-01 728 0.401E+00 0.170E+00
DAV: 9 -0.907180898570E+02 0.91485E-01 -0.13206E-01 728 0.159E+00 0.423E-01
DAV: 10 -0.907080386294E+02 0.10051E-01 -0.35020E-02 768 0.935E-01 0.279E-01
DAV: 11 -0.907119930459E+02 -0.39544E-02 -0.87943E-03 610 0.482E-01 0.139E-01
DAV: 12 -0.907147295837E+02 -0.27365E-02 -0.17818E-03 648 0.243E-01 0.842E-02
DAV: 13 -0.907189025513E+02 -0.41730E-02 -0.17982E-03 633 0.200E-01 0.636E-02
DAV: 14 -0.907223676152E+02 -0.34651E-02 -0.13524E-03 789 0.274E-01 0.504E-02
DAV: 15 -0.907239393217E+02 -0.15717E-02 -0.37970E-04 701 0.110E-01 0.470E-02
DAV: 16 -0.907250804125E+02 -0.11411E-02 -0.41277E-04 749 0.127E-01 0.193E-02
DAV: 17 -0.907259384297E+02 -0.85802E-03 -0.16289E-04 690 0.633E-02 0.179E-02
DAV: 18 -0.907262279570E+02 -0.28953E-03 -0.23316E-05 568 0.216E-02 0.132E-02
DAV: 19 -0.907263665577E+02 -0.13860E-03 -0.44514E-05 634 0.396E-02 0.401E-03
DAV: 20 -0.907263887378E+02 -0.22180E-04 -0.57787E-06 512 0.149E-02 0.360E-03
DAV: 21 -0.907264157194E+02 -0.26982E-04 -0.40817E-06 398 0.939E-03 0.268E-03
DAV: 22 -0.907264185772E+02 -0.28577E-05 -0.66619E-07 512 0.577E-03
1 F= -.90726419E+02 E0= -.90731448E+02 d E =0.150880E-01