iterations/neb2_max2_image04_iter8_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422760135615E+04 0.42276E+04 -0.25386E+05 8992 0.103E+03
DAV: 2 -0.102882235274E+03 -0.43305E+04 -0.39284E+04 11000 0.248E+02
DAV: 3 -0.425977349854E+03 -0.32310E+03 -0.30255E+03 10240 0.657E+01
DAV: 4 -0.434549892829E+03 -0.85725E+01 -0.84683E+01 10864 0.108E+01
DAV: 5 -0.434847713095E+03 -0.29782E+00 -0.29694E+00 11136 0.195E+00 0.989E+01
RMM: 6 -0.377637553054E+03 0.57210E+02 -0.11468E+02 9682 0.146E+01 0.679E+01
RMM: 7 -0.529313178509E+03 -0.15168E+03 -0.18493E+02 10095 0.156E+01 0.956E+01
RMM: 8 -0.458655429131E+03 0.70658E+02 -0.86131E+01 10164 0.114E+01 0.707E+01
RMM: 9 -0.438218331490E+03 0.20437E+02 -0.42239E+01 10174 0.751E+00 0.637E+01
RMM: 10 -0.397487432324E+03 0.40731E+02 -0.44301E+01 10420 0.805E+00 0.449E+01
RMM: 11 -0.377739632312E+03 0.19748E+02 -0.77984E+00 9609 0.402E+00 0.285E+01
RMM: 12 -0.374731733187E+03 0.30079E+01 -0.53149E+00 10151 0.300E+00 0.222E+01
RMM: 13 -0.374315514852E+03 0.41622E+00 -0.25116E+00 10187 0.199E+00 0.138E+01
RMM: 14 -0.376868361355E+03 -0.25528E+01 -0.11568E+00 10212 0.130E+00 0.119E+01
RMM: 15 -0.381357397915E+03 -0.44890E+01 -0.98924E-01 10392 0.126E+00 0.114E+01
RMM: 16 -0.387500391383E+03 -0.61430E+01 -0.26408E+00 11616 0.189E+00 0.103E+01
RMM: 17 -0.392699316119E+03 -0.51989E+01 -0.16421E+00 11286 0.150E+00 0.889E+00
RMM: 18 -0.393820321247E+03 -0.11210E+01 -0.37909E-01 10247 0.791E-01 0.757E+00
RMM: 19 -0.396597896329E+03 -0.27776E+01 -0.69298E-01 11223 0.907E-01 0.667E+00
RMM: 20 -0.398729591485E+03 -0.21317E+01 -0.40269E-01 11079 0.686E-01 0.601E+00
RMM: 21 -0.399485932127E+03 -0.75634E+00 -0.76977E-02 10456 0.307E-01 0.576E+00
RMM: 22 -0.401630569370E+03 -0.21446E+01 -0.50347E-01 12183 0.722E-01 0.553E+00
RMM: 23 -0.405238487477E+03 -0.36079E+01 -0.13957E+00 13788 0.117E+00 0.521E+00
RMM: 24 -0.409023001337E+03 -0.37845E+01 -0.14994E+00 14147 0.114E+00 0.615E+00
RMM: 25 -0.410975333592E+03 -0.19523E+01 -0.78696E-01 13267 0.821E-01 0.585E+00
RMM: 26 -0.411804116912E+03 -0.82878E+00 -0.75239E-02 10712 0.288E-01 0.589E+00
RMM: 27 -0.411655536340E+03 0.14858E+00 -0.31352E-02 10280 0.208E-01 0.548E+00
RMM: 28 -0.411289862533E+03 0.36567E+00 -0.81424E-02 11347 0.342E-01 0.507E+00
RMM: 29 -0.411214566397E+03 0.75296E-01 -0.46018E-02 10698 0.273E-01 0.486E+00
RMM: 30 -0.411012655900E+03 0.20191E+00 -0.15168E-01 12555 0.481E-01 0.608E+00
RMM: 31 -0.411291743921E+03 -0.27909E+00 -0.10209E-02 10060 0.143E-01 0.568E+00
RMM: 32 -0.412419851513E+03 -0.11281E+01 -0.82758E-01 16015 0.974E-01 0.544E+00
RMM: 33 -0.412618199720E+03 -0.19835E+00 -0.29920E-01 15277 0.598E-01 0.512E+00
RMM: 34 -0.413559566778E+03 -0.94137E+00 -0.10860E-01 13448 0.368E-01 0.313E+00
RMM: 35 -0.413775684207E+03 -0.21612E+00 -0.54159E-03 10357 0.977E-02 0.281E+00
RMM: 36 -0.413871975834E+03 -0.96292E-01 -0.29670E-03 10292 0.773E-02 0.273E+00
RMM: 37 -0.414570829112E+03 -0.69885E+00 -0.54531E-02 14915 0.306E-01 0.151E+00
RMM: 38 -0.415032940123E+03 -0.46211E+00 -0.23659E-02 13554 0.182E-01 0.116E+00
RMM: 39 -0.415443917686E+03 -0.41098E+00 -0.15712E-02 12683 0.138E-01 0.106E+00
RMM: 40 -0.415764439201E+03 -0.32052E+00 -0.14324E-02 12168 0.126E-01 0.765E-01
RMM: 41 -0.415900660140E+03 -0.13622E+00 -0.29207E-02 12969 0.159E-01 0.701E-01
RMM: 42 -0.415890930939E+03 0.97292E-02 -0.10326E-02 11746 0.992E-02 0.637E-01
RMM: 43 -0.416000828848E+03 -0.10990E+00 -0.60600E-03 11276 0.774E-02 0.598E-01
RMM: 44 -0.416097816458E+03 -0.96988E-01 -0.12236E-02 12224 0.970E-02 0.524E-01
RMM: 45 -0.416200346289E+03 -0.10253E+00 -0.99868E-03 12263 0.873E-02 0.417E-01
RMM: 46 -0.416327523636E+03 -0.12718E+00 -0.69476E-03 11875 0.764E-02 0.307E-01
RMM: 47 -0.416382040867E+03 -0.54517E-01 -0.14351E-03 10848 0.373E-02 0.227E-01
RMM: 48 -0.416466404470E+03 -0.84364E-01 -0.14094E-03 11126 0.358E-02 0.208E-01
RMM: 49 -0.416536134509E+03 -0.69730E-01 -0.71870E-04 10859 0.265E-02 0.139E-01
RMM: 50 -0.416563435877E+03 -0.27301E-01 -0.40752E-04 10711 0.195E-02 0.817E-02
RMM: 51 -0.416566882917E+03 -0.34470E-02 -0.12574E-04 9959 0.123E-02 0.606E-02
RMM: 52 -0.416569625529E+03 -0.27426E-02 -0.72394E-05 8742 0.823E-03 0.409E-02
RMM: 53 -0.416572590667E+03 -0.29651E-02 -0.60315E-05 8606 0.739E-03 0.378E-02
RMM: 54 -0.416574243114E+03 -0.16524E-02 -0.26973E-05 7679 0.524E-03 0.294E-02
RMM: 55 -0.416575524063E+03 -0.12809E-02 -0.20033E-05 7263 0.407E-03 0.213E-02
RMM: 56 -0.416576258025E+03 -0.73396E-03 -0.10243E-05 6641 0.316E-03 0.128E-02
RMM: 57 -0.416577004415E+03 -0.74639E-03 -0.55680E-06 6522 0.233E-03 0.985E-03
RMM: 58 -0.416577504668E+03 -0.50025E-03 -0.40226E-06 6443 0.198E-03 0.201E-02
RMM: 59 -0.416577811399E+03 -0.30673E-03 -0.20234E-06 4474 0.123E-03 0.193E-02
RMM: 60 -0.416577957134E+03 -0.14574E-03 -0.13247E-06 4186 0.117E-03 0.107E-02
RMM: 61 -0.416578074634E+03 -0.11750E-03 -0.20647E-06 5525 0.144E-03 0.113E-02
RMM: 62 -0.416578080979E+03 -0.63450E-05 -0.34309E-07 3129 0.951E-04
1 F= -.45429745E+03 E0= -.45429700E+03 d E =-.134926E-02 mag= -0.0074