iterations/neb2_max2_image03_iter3_OSZICAR.out output for 564: 4940072_SO2_t_3990147
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.422343264710E+04 0.42234E+04 -0.25381E+05 8992 0.103E+03
DAV: 2 -0.102204914247E+03 -0.43256E+04 -0.39228E+04 10992 0.248E+02
DAV: 3 -0.425414120267E+03 -0.32321E+03 -0.30249E+03 10248 0.657E+01
DAV: 4 -0.434071292293E+03 -0.86572E+01 -0.85470E+01 10864 0.108E+01
DAV: 5 -0.434368148541E+03 -0.29686E+00 -0.29597E+00 11224 0.194E+00 0.988E+01
RMM: 6 -0.378999897753E+03 0.55368E+02 -0.11397E+02 9690 0.146E+01 0.689E+01
RMM: 7 -0.590967276817E+03 -0.21197E+03 -0.23106E+02 10357 0.165E+01 0.111E+02
RMM: 8 -0.522571170017E+03 0.68396E+02 -0.11184E+02 10277 0.114E+01 0.924E+01
RMM: 9 -0.390238592134E+03 0.13233E+03 -0.48948E+01 10143 0.873E+00 0.403E+01
RMM: 10 -0.402180627487E+03 -0.11942E+02 -0.33449E+01 10285 0.725E+00 0.486E+01
RMM: 11 -0.374633102713E+03 0.27548E+02 -0.10013E+01 9841 0.426E+00 0.163E+01
RMM: 12 -0.375956682522E+03 -0.13236E+01 -0.31236E+00 10419 0.209E+00 0.153E+01
RMM: 13 -0.377892758905E+03 -0.19361E+01 -0.14584E+00 10206 0.155E+00 0.131E+01
RMM: 14 -0.380962099589E+03 -0.30693E+01 -0.10320E+00 10319 0.133E+00 0.102E+01
RMM: 15 -0.384412740956E+03 -0.34506E+01 -0.53683E-01 10264 0.981E-01 0.882E+00
RMM: 16 -0.388628690792E+03 -0.42159E+01 -0.11383E+00 11373 0.128E+00 0.969E+00
RMM: 17 -0.391663999514E+03 -0.30353E+01 -0.10878E+00 11412 0.120E+00 0.759E+00
RMM: 18 -0.394654796510E+03 -0.29908E+01 -0.80104E-01 11262 0.992E-01 0.620E+00
RMM: 19 -0.397900984259E+03 -0.32462E+01 -0.68726E-01 11365 0.885E-01 0.640E+00
RMM: 20 -0.400659622385E+03 -0.27586E+01 -0.88070E-01 11778 0.965E-01 0.562E+00
RMM: 21 -0.405222184652E+03 -0.45626E+01 -0.19516E+00 12877 0.131E+00 0.545E+00
RMM: 22 -0.408833083607E+03 -0.36109E+01 -0.27346E+00 13601 0.140E+00 0.610E+00
RMM: 23 -0.410509286347E+03 -0.16762E+01 -0.36657E-01 11351 0.576E-01 0.603E+00
RMM: 24 -0.411139053292E+03 -0.62977E+00 -0.33709E-02 10680 0.192E-01 0.592E+00
RMM: 25 -0.411354258331E+03 -0.21521E+00 -0.18134E-02 10440 0.133E-01 0.599E+00
RMM: 26 -0.411864679780E+03 -0.51042E+00 -0.15391E-01 13051 0.370E-01 0.597E+00
RMM: 27 -0.412337293116E+03 -0.47261E+00 -0.15703E-01 13392 0.425E-01 0.516E+00
RMM: 28 -0.412702144876E+03 -0.36485E+00 -0.64602E-02 12189 0.307E-01 0.434E+00
RMM: 29 -0.413332030021E+03 -0.62989E+00 -0.42480E-02 11436 0.253E-01 0.382E+00
RMM: 30 -0.413987526069E+03 -0.65550E+00 -0.11657E-01 13049 0.381E-01 0.361E+00
RMM: 31 -0.414195937352E+03 -0.20841E+00 -0.67174E-02 12080 0.317E-01 0.277E+00
RMM: 32 -0.414400603356E+03 -0.20467E+00 -0.29507E-02 10974 0.208E-01 0.201E+00
RMM: 33 -0.414581998867E+03 -0.18140E+00 -0.97143E-03 10336 0.120E-01 0.162E+00
RMM: 34 -0.414722487275E+03 -0.14049E+00 -0.95299E-03 10660 0.118E-01 0.144E+00
RMM: 35 -0.414815987830E+03 -0.93501E-01 -0.81186E-03 10765 0.988E-02 0.117E+00
RMM: 36 -0.414949736447E+03 -0.13375E+00 -0.67098E-03 10864 0.884E-02 0.756E-01
RMM: 37 -0.415122787894E+03 -0.17305E+00 -0.49149E-03 10821 0.787E-02 0.612E-01
RMM: 38 -0.415186788775E+03 -0.64001E-01 -0.21233E-03 10471 0.551E-02 0.600E-01
RMM: 39 -0.415225388375E+03 -0.38600E-01 -0.26282E-03 10852 0.614E-02 0.611E-01
RMM: 40 -0.415267954446E+03 -0.42566E-01 -0.55698E-03 11816 0.809E-02 0.392E-01
RMM: 41 -0.415388096120E+03 -0.12014E+00 -0.84781E-03 12323 0.837E-02 0.445E-01
RMM: 42 -0.415444296973E+03 -0.56201E-01 -0.10111E-02 12496 0.863E-02 0.418E-01
RMM: 43 -0.415487184975E+03 -0.42888E-01 -0.32221E-03 11418 0.510E-02 0.289E-01
RMM: 44 -0.415555773123E+03 -0.68588E-01 -0.44167E-03 11910 0.528E-02 0.188E-01
RMM: 45 -0.415619583612E+03 -0.63810E-01 -0.51589E-03 12152 0.564E-02 0.150E-01
RMM: 46 -0.415687246803E+03 -0.67663E-01 -0.30275E-03 11903 0.433E-02 0.129E-01
RMM: 47 -0.415749210262E+03 -0.61963E-01 -0.15198E-03 11671 0.317E-02 0.770E-02
RMM: 48 -0.415789597834E+03 -0.40388E-01 -0.53645E-04 11024 0.203E-02 0.742E-02
RMM: 49 -0.415812062390E+03 -0.22465E-01 -0.21682E-04 9756 0.131E-02 0.505E-02
RMM: 50 -0.415819433502E+03 -0.73711E-02 -0.79880E-05 8871 0.815E-03 0.340E-02
RMM: 51 -0.415822315120E+03 -0.28816E-02 -0.36590E-05 8021 0.548E-03 0.249E-02
RMM: 52 -0.415823823540E+03 -0.15084E-02 -0.27847E-05 7573 0.448E-03 0.178E-02
RMM: 53 -0.415824414002E+03 -0.59046E-03 -0.12911E-05 6955 0.307E-03 0.123E-02
RMM: 54 -0.415824684460E+03 -0.27046E-03 -0.53894E-06 5690 0.198E-03 0.690E-03
RMM: 55 -0.415824778662E+03 -0.94202E-04 -0.24257E-06 4835 0.144E-03 0.531E-03
RMM: 56 -0.415824817143E+03 -0.38480E-04 -0.18557E-06 4369 0.127E-03 0.494E-03
RMM: 57 -0.415825040980E+03 -0.22384E-03 -0.17635E-06 4374 0.120E-03 0.482E-03
RMM: 58 -0.415825190304E+03 -0.14932E-03 -0.10130E-06 3489 0.994E-04 0.337E-03
RMM: 59 -0.415825318380E+03 -0.12808E-03 -0.99443E-07 3811 0.102E-03 0.334E-03
RMM: 60 -0.415825434212E+03 -0.11583E-03 -0.86683E-07 3857 0.102E-03 0.466E-03
RMM: 61 -0.415825492527E+03 -0.58315E-04 -0.25300E-07 2816 0.847E-04 0.208E-03
RMM: 62 -0.415825599487E+03 -0.10696E-03 -0.92878E-07 3797 0.104E-03 0.599E-03
RMM: 63 -0.415825648414E+03 -0.48927E-04 -0.40145E-07 3145 0.906E-04 0.520E-03
RMM: 64 -0.415825664357E+03 -0.15943E-04 -0.82382E-08 2429 0.798E-04 0.359E-03
RMM: 65 -0.415825690060E+03 -0.25703E-04 -0.64609E-08 2385 0.801E-04 0.196E-03
RMM: 66 -0.415825725584E+03 -0.35524E-04 -0.27217E-07 2858 0.876E-04 0.709E-04
RMM: 67 -0.415825738489E+03 -0.12906E-04 -0.12475E-07 2500 0.829E-04 0.653E-04
RMM: 68 -0.415825747995E+03 -0.95052E-05 -0.13416E-07 2446 0.827E-04
1 F= -.45355133E+03 E0= -.45355092E+03 d E =-.123460E-02 mag= -0.0002