You can not select more than 25 topics
Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.
385 lines
18 KiB
385 lines
18 KiB
Start of run 0.000
|
|
-------------- end of scf step 56.978
|
|
-------------- end of scf step 64.924
|
|
-------------- end of scf step 72.987
|
|
-------------- end of scf step 80.904
|
|
-------------- end of scf step 88.821
|
|
-------------- end of scf step 96.737
|
|
-------------- end of scf step 104.683
|
|
-------------- end of scf step 112.640
|
|
-------------- end of scf step 120.582
|
|
-------------- end of scf step 128.524
|
|
-------------- end of scf step 136.457
|
|
-------------- end of scf step 144.411
|
|
-------------- end of scf step 152.358
|
|
-------------- end of scf step 160.363
|
|
-------------- end of scf step 168.352
|
|
-------------- end of scf step 176.304
|
|
-------------- end of scf step 184.251
|
|
-------------- end of scf step 192.213
|
|
-------------- end of scf step 200.170
|
|
-------------- end of scf step 208.114
|
|
-------------- end of scf step 216.053
|
|
-------------- end of scf step 224.017
|
|
-------------- end of scf step 231.935
|
|
-------------- end of scf step 239.863
|
|
-------------- end of scf step 248.322
|
|
-------------- end of scf step 256.303
|
|
-------------- end of scf step 264.256
|
|
-------------- end of scf step 272.206
|
|
-------------- end of scf step 280.150
|
|
-------------- end of scf step 288.089
|
|
-------------- end of scf step 296.045
|
|
-------------- end of scf step 304.008
|
|
-------------- end of scf step 311.961
|
|
-------------- end of scf step 319.913
|
|
-------------- end of scf step 327.867
|
|
-------------- end of scf step 335.825
|
|
-------------- end of scf step 343.802
|
|
-------------- end of scf step 351.752
|
|
-------------- end of scf step 359.706
|
|
-------------- end of scf step 367.668
|
|
-------------- end of scf step 375.740
|
|
-------------- end of scf step 383.726
|
|
-------------- end of scf step 391.662
|
|
-------------- end of scf step 399.569
|
|
-------------- end of scf step 407.524
|
|
-------------- end of scf step 415.483
|
|
-------------- end of scf step 423.441
|
|
-------------- end of scf step 431.406
|
|
-------------- end of scf step 439.350
|
|
-------------- end of scf step 447.299
|
|
-------------- end of scf step 455.236
|
|
-------------- end of scf step 463.207
|
|
-------------- end of scf step 471.154
|
|
-------------- end of scf step 479.088
|
|
-------------- end of scf step 487.047
|
|
-------------- end of scf step 495.021
|
|
-------------- end of scf step 502.995
|
|
-------------- end of scf step 510.939
|
|
-------------- end of scf step 518.898
|
|
-------------- end of scf step 526.843
|
|
-------------- end of scf step 534.782
|
|
-------------- end of scf step 542.739
|
|
-------------- end of scf step 550.660
|
|
-------------- end of scf step 558.628
|
|
-------------- end of scf step 566.566
|
|
-------------- end of scf step 574.485
|
|
-------------- end of scf step 582.421
|
|
-------------- end of scf step 590.349
|
|
-------------- end of scf step 598.269
|
|
-------------- end of scf step 606.208
|
|
-------------- end of scf step 614.151
|
|
-------------- end of scf step 622.104
|
|
-------------- end of scf step 630.054
|
|
-------------- end of scf step 637.984
|
|
-------------- end of scf step 645.938
|
|
-------------- end of scf step 653.941
|
|
-------------- end of scf step 661.887
|
|
-------------- end of scf step 669.816
|
|
-------------- end of scf step 677.785
|
|
-------------- end of scf step 685.709
|
|
-------------- end of scf step 693.620
|
|
-------------- end of scf step 701.590
|
|
-------------- end of scf step 709.539
|
|
-------------- end of scf step 718.443
|
|
-------------- end of scf step 726.373
|
|
-------------- end of scf step 734.353
|
|
-------------- end of scf step 742.316
|
|
-------------- end of scf step 750.271
|
|
-------------- end of scf step 758.221
|
|
-------------- end of scf step 766.199
|
|
-------------- end of scf step 774.123
|
|
-------------- end of scf step 782.071
|
|
-------------- end of scf step 790.051
|
|
-------------- end of scf step 798.061
|
|
-------------- end of scf step 806.009
|
|
-------------- end of scf step 813.963
|
|
--- end of geometry step 1009.026
|
|
-------------- end of scf step 1035.442
|
|
-------------- end of scf step 1043.091
|
|
-------------- end of scf step 1050.845
|
|
-------------- end of scf step 1058.453
|
|
-------------- end of scf step 1066.077
|
|
-------------- end of scf step 1073.718
|
|
-------------- end of scf step 1081.385
|
|
-------------- end of scf step 1089.027
|
|
-------------- end of scf step 1096.637
|
|
-------------- end of scf step 1104.283
|
|
-------------- end of scf step 1111.959
|
|
-------------- end of scf step 1119.612
|
|
-------------- end of scf step 1127.210
|
|
-------------- end of scf step 1134.851
|
|
-------------- end of scf step 1142.643
|
|
-------------- end of scf step 1150.278
|
|
-------------- end of scf step 1157.902
|
|
-------------- end of scf step 1165.540
|
|
-------------- end of scf step 1173.175
|
|
-------------- end of scf step 1180.805
|
|
-------------- end of scf step 1188.401
|
|
-------------- end of scf step 1196.127
|
|
-------------- end of scf step 1203.764
|
|
-------------- end of scf step 1211.387
|
|
-------------- end of scf step 1219.021
|
|
-------------- end of scf step 1226.641
|
|
-------------- end of scf step 1234.333
|
|
-------------- end of scf step 1241.929
|
|
--- end of geometry step 1437.577
|
|
-------------- end of scf step 1463.543
|
|
-------------- end of scf step 1470.916
|
|
-------------- end of scf step 1478.372
|
|
-------------- end of scf step 1485.737
|
|
-------------- end of scf step 1493.108
|
|
-------------- end of scf step 1500.480
|
|
-------------- end of scf step 1507.894
|
|
-------------- end of scf step 1515.241
|
|
-------------- end of scf step 1522.591
|
|
-------------- end of scf step 1529.965
|
|
-------------- end of scf step 1537.311
|
|
-------------- end of scf step 1544.727
|
|
-------------- end of scf step 1552.082
|
|
-------------- end of scf step 1559.426
|
|
-------------- end of scf step 1566.789
|
|
-------------- end of scf step 1574.163
|
|
-------------- end of scf step 1581.532
|
|
-------------- end of scf step 1588.883
|
|
-------------- end of scf step 1596.245
|
|
-------------- end of scf step 1603.698
|
|
-------------- end of scf step 1611.077
|
|
-------------- end of scf step 1618.462
|
|
-------------- end of scf step 1625.858
|
|
-------------- end of scf step 1633.226
|
|
-------------- end of scf step 1640.589
|
|
-------------- end of scf step 1647.938
|
|
-------------- end of scf step 1655.320
|
|
-------------- end of scf step 1662.699
|
|
-------------- end of scf step 1670.069
|
|
-------------- end of scf step 1677.435
|
|
-------------- end of scf step 1684.780
|
|
-------------- end of scf step 1692.172
|
|
-------------- end of scf step 1699.533
|
|
-------------- end of scf step 1706.908
|
|
-------------- end of scf step 1714.277
|
|
-------------- end of scf step 1721.685
|
|
-------------- end of scf step 1729.045
|
|
-------------- end of scf step 1736.418
|
|
-------------- end of scf step 1743.779
|
|
-------------- end of scf step 1751.178
|
|
-------------- end of scf step 1758.540
|
|
-------------- end of scf step 1765.885
|
|
-------------- end of scf step 1773.257
|
|
-------------- end of scf step 1780.621
|
|
-------------- end of scf step 1788.005
|
|
-------------- end of scf step 1795.374
|
|
-------------- end of scf step 1802.780
|
|
--- end of geometry step 2000.647
|
|
-------------- end of scf step 2026.475
|
|
-------------- end of scf step 2033.847
|
|
-------------- end of scf step 2041.191
|
|
-------------- end of scf step 2048.534
|
|
-------------- end of scf step 2055.881
|
|
-------------- end of scf step 2063.244
|
|
-------------- end of scf step 2070.593
|
|
-------------- end of scf step 2077.919
|
|
-------------- end of scf step 2085.269
|
|
-------------- end of scf step 2092.625
|
|
-------------- end of scf step 2099.973
|
|
-------------- end of scf step 2107.296
|
|
-------------- end of scf step 2114.637
|
|
-------------- end of scf step 2121.955
|
|
-------------- end of scf step 2129.382
|
|
-------------- end of scf step 2136.719
|
|
-------------- end of scf step 2144.051
|
|
-------------- end of scf step 2151.390
|
|
-------------- end of scf step 2159.103
|
|
-------------- end of scf step 2166.415
|
|
--- end of geometry step 2356.565
|
|
-------------- end of scf step 2382.391
|
|
-------------- end of scf step 2389.758
|
|
-------------- end of scf step 2397.100
|
|
-------------- end of scf step 2404.449
|
|
-------------- end of scf step 2411.811
|
|
-------------- end of scf step 2419.151
|
|
-------------- end of scf step 2426.508
|
|
-------------- end of scf step 2433.820
|
|
-------------- end of scf step 2441.176
|
|
-------------- end of scf step 2448.522
|
|
-------------- end of scf step 2455.853
|
|
-------------- end of scf step 2463.189
|
|
-------------- end of scf step 2470.526
|
|
-------------- end of scf step 2477.839
|
|
-------------- end of scf step 2485.254
|
|
-------------- end of scf step 2492.571
|
|
-------------- end of scf step 2499.923
|
|
-------------- end of scf step 2507.237
|
|
-------------- end of scf step 2514.601
|
|
-------------- end of scf step 2521.966
|
|
-------------- end of scf step 2529.287
|
|
-------------- end of scf step 2536.636
|
|
-------------- end of scf step 2543.973
|
|
-------------- end of scf step 2551.313
|
|
-------------- end of scf step 2558.669
|
|
-------------- end of scf step 2566.004
|
|
-------------- end of scf step 2573.469
|
|
-------------- end of scf step 2580.814
|
|
-------------- end of scf step 2588.170
|
|
-------------- end of scf step 2595.483
|
|
-------------- end of scf step 2602.818
|
|
-------------- end of scf step 2610.175
|
|
-------------- end of scf step 2617.521
|
|
-------------- end of scf step 2624.864
|
|
-------------- end of scf step 2632.216
|
|
-------------- end of scf step 2639.522
|
|
-------------- end of scf step 2646.850
|
|
-------------- end of scf step 2654.156
|
|
-------------- end of scf step 2662.595
|
|
-------------- end of scf step 2669.963
|
|
-------------- end of scf step 2677.355
|
|
-------------- end of scf step 2684.696
|
|
-------------- end of scf step 2692.020
|
|
-------------- end of scf step 2699.337
|
|
-------------- end of scf step 2706.683
|
|
-------------- end of scf step 2713.992
|
|
-------------- end of scf step 2721.327
|
|
-------------- end of scf step 2728.635
|
|
--- end of geometry step 2917.265
|
|
-------------- end of scf step 2943.048
|
|
-------------- end of scf step 2950.420
|
|
-------------- end of scf step 2957.735
|
|
-------------- end of scf step 2965.075
|
|
-------------- end of scf step 2972.406
|
|
-------------- end of scf step 2979.737
|
|
-------------- end of scf step 2987.060
|
|
-------------- end of scf step 2994.399
|
|
-------------- end of scf step 3001.756
|
|
-------------- end of scf step 3009.090
|
|
-------------- end of scf step 3016.428
|
|
-------------- end of scf step 3023.745
|
|
-------------- end of scf step 3031.089
|
|
-------------- end of scf step 3038.425
|
|
-------------- end of scf step 3045.751
|
|
-------------- end of scf step 3053.151
|
|
-------------- end of scf step 3060.493
|
|
-------------- end of scf step 3067.806
|
|
-------------- end of scf step 3075.138
|
|
-------------- end of scf step 3082.461
|
|
-------------- end of scf step 3089.777
|
|
-------------- end of scf step 3097.101
|
|
-------------- end of scf step 3104.460
|
|
-------------- end of scf step 3111.788
|
|
-------------- end of scf step 3119.137
|
|
-------------- end of scf step 3126.496
|
|
-------------- end of scf step 3133.835
|
|
--- end of geometry step 3320.974
|
|
-------------- end of scf step 3346.762
|
|
-------------- end of scf step 3354.120
|
|
-------------- end of scf step 3361.540
|
|
-------------- end of scf step 3368.895
|
|
-------------- end of scf step 3376.263
|
|
-------------- end of scf step 3383.627
|
|
-------------- end of scf step 3391.020
|
|
-------------- end of scf step 3398.367
|
|
-------------- end of scf step 3405.715
|
|
-------------- end of scf step 3413.101
|
|
-------------- end of scf step 3420.512
|
|
-------------- end of scf step 3427.888
|
|
-------------- end of scf step 3435.281
|
|
-------------- end of scf step 3442.662
|
|
-------------- end of scf step 3450.062
|
|
-------------- end of scf step 3457.412
|
|
-------------- end of scf step 3464.772
|
|
-------------- end of scf step 3472.132
|
|
-------------- end of scf step 3479.519
|
|
-------------- end of scf step 3486.941
|
|
-------------- end of scf step 3494.312
|
|
-------------- end of scf step 3501.653
|
|
-------------- end of scf step 3509.011
|
|
-------------- end of scf step 3516.350
|
|
-------------- end of scf step 3523.704
|
|
-------------- end of scf step 3531.084
|
|
-------------- end of scf step 3538.452
|
|
--- end of geometry step 3721.863
|
|
-------------- end of scf step 3747.632
|
|
-------------- end of scf step 3755.009
|
|
-------------- end of scf step 3762.372
|
|
-------------- end of scf step 3769.734
|
|
-------------- end of scf step 3777.067
|
|
-------------- end of scf step 3784.425
|
|
-------------- end of scf step 3791.777
|
|
-------------- end of scf step 3799.125
|
|
-------------- end of scf step 3806.482
|
|
-------------- end of scf step 3813.812
|
|
-------------- end of scf step 3821.185
|
|
-------------- end of scf step 3828.513
|
|
-------------- end of scf step 3835.871
|
|
-------------- end of scf step 3843.224
|
|
-------------- end of scf step 3850.641
|
|
-------------- end of scf step 3858.045
|
|
-------------- end of scf step 3865.619
|
|
-------------- end of scf step 3872.968
|
|
-------------- end of scf step 3880.306
|
|
-------------- end of scf step 3887.668
|
|
-------------- end of scf step 3895.018
|
|
-------------- end of scf step 3902.366
|
|
-------------- end of scf step 3909.681
|
|
-------------- end of scf step 3917.004
|
|
-------------- end of scf step 3924.330
|
|
-------------- end of scf step 3931.678
|
|
--- end of geometry step 4121.337
|
|
-------------- end of scf step 4147.131
|
|
-------------- end of scf step 4154.513
|
|
-------------- end of scf step 4161.864
|
|
-------------- end of scf step 4169.450
|
|
-------------- end of scf step 4176.820
|
|
-------------- end of scf step 4184.180
|
|
-------------- end of scf step 4191.587
|
|
-------------- end of scf step 4198.929
|
|
-------------- end of scf step 4206.312
|
|
-------------- end of scf step 4213.671
|
|
-------------- end of scf step 4221.102
|
|
-------------- end of scf step 4228.474
|
|
-------------- end of scf step 4235.843
|
|
-------------- end of scf step 4243.204
|
|
-------------- end of scf step 4250.585
|
|
-------------- end of scf step 4257.933
|
|
-------------- end of scf step 4265.301
|
|
-------------- end of scf step 4272.687
|
|
-------------- end of scf step 4280.044
|
|
-------------- end of scf step 4287.418
|
|
-------------- end of scf step 4294.761
|
|
-------------- end of scf step 4302.122
|
|
-------------- end of scf step 4309.508
|
|
-------------- end of scf step 4316.870
|
|
-------------- end of scf step 4324.243
|
|
-------------- end of scf step 4331.617
|
|
--- end of geometry step 4518.074
|
|
-------------- end of scf step 4543.812
|
|
-------------- end of scf step 4551.214
|
|
-------------- end of scf step 4558.566
|
|
-------------- end of scf step 4565.937
|
|
-------------- end of scf step 4573.306
|
|
-------------- end of scf step 4580.664
|
|
-------------- end of scf step 4588.051
|
|
-------------- end of scf step 4595.403
|
|
-------------- end of scf step 4602.786
|
|
-------------- end of scf step 4610.174
|
|
-------------- end of scf step 4617.553
|
|
-------------- end of scf step 4624.941
|
|
-------------- end of scf step 4632.348
|
|
-------------- end of scf step 4639.728
|
|
-------------- end of scf step 4647.117
|
|
-------------- end of scf step 4654.482
|
|
-------------- end of scf step 4661.852
|
|
-------------- end of scf step 4669.223
|
|
-------------- end of scf step 4676.651
|
|
-------------- end of scf step 4684.008
|
|
-------------- end of scf step 4691.378
|
|
-------------- end of scf step 4698.749
|
|
-------------- end of scf step 4706.128
|
|
-------------- end of scf step 4713.471
|
|
-------------- end of scf step 4720.839
|
|
-------------- end of scf step 4728.200
|
|
-------------- end of scf step 4735.555
|
|
--- end of geometry step 4920.824
|
|
End of run 4921.133
|