 vasp.6.3.2 27Jun22 (build Sep 27 2026 18:28:07) complex                        
  energy without entropy =      411.54369067  energy(sigma->0) =      411.53664171
  energy without entropy =       46.95363804  energy(sigma->0) =       46.94317199
  energy without entropy =      -17.31202275  energy(sigma->0) =      -17.32543741
  energy without entropy =      -20.24199879  energy(sigma->0) =      -20.25610332
  energy without entropy =      -20.29654034  energy(sigma->0) =      -20.31064531
  energy without entropy =      -17.61323871  energy(sigma->0) =      -17.62114610
  energy without entropy =      -17.18601140  energy(sigma->0) =      -17.19398166
  energy without entropy =      -16.65935276  energy(sigma->0) =      -16.66550721
  energy without entropy =      -16.62492700  energy(sigma->0) =      -16.63099959
  energy without entropy =      -16.57687762  energy(sigma->0) =      -16.58275920
  energy without entropy =      -16.56331946  energy(sigma->0) =      -16.56917235
  energy without entropy =      -16.54169399  energy(sigma->0) =      -16.54762907
  energy without entropy =      -16.53609776  energy(sigma->0) =      -16.54189614
  energy without entropy =      -16.53589572  energy(sigma->0) =      -16.54167011
  energy without entropy =      -16.53559380  energy(sigma->0) =      -16.54144897
  energy without entropy =      -16.53546362  energy(sigma->0) =      -16.54131248
  energy without entropy =      -16.53541246  energy(sigma->0) =      -16.54125570
  energy without entropy =      -16.53543622  energy(sigma->0) =      -16.54126544
  energy without entropy =      -16.53543266  energy(sigma->0) =      -16.54126382
  energy without entropy =      -16.53542444  energy(sigma->0) =      -16.54126004
 E-fermi :  -4.8964     XC(G=0):  -5.8857     alpha+bet : -5.2041
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.53790959  energy(sigma->0) =      -16.54372672
  energy without entropy =      -16.53790960  energy(sigma->0) =      -16.54372673
  energy without entropy =      -16.53790960  energy(sigma->0) =      -16.54372673
  energy without entropy =      -16.53790960  energy(sigma->0) =      -16.54372673
  energy without entropy =      -16.53790960  energy(sigma->0) =      -16.54372673
  energy without entropy =      -16.53793114  energy(sigma->0) =      -16.54379329
  energy without entropy =      -16.53792886  energy(sigma->0) =      -16.54378989
  energy without entropy =      -16.53791977  energy(sigma->0) =      -16.54377772
  energy without entropy =      -16.53791835  energy(sigma->0) =      -16.54377569
  energy without entropy =      -16.53791572  energy(sigma->0) =      -16.54377234
  energy without entropy =      -16.53790399  energy(sigma->0) =      -16.54375514
  energy without entropy =      -16.53788909  energy(sigma->0) =      -16.54371856
  energy without entropy =      -16.53789894  energy(sigma->0) =      -16.54372057
  energy without entropy =      -16.53790061  energy(sigma->0) =      -16.54372216
  energy without entropy =      -16.53790531  energy(sigma->0) =      -16.54372429
 E-fermi :  -4.8891     XC(G=0):  -5.9008     alpha+bet : -5.2041
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.55279394  energy(sigma->0) =      -16.55850134
  energy without entropy =      -16.55279394  energy(sigma->0) =      -16.55850134
  energy without entropy =      -16.55279394  energy(sigma->0) =      -16.55850134
  energy without entropy =      -16.55279394  energy(sigma->0) =      -16.55850134
  energy without entropy =      -16.55279394  energy(sigma->0) =      -16.55850134
  energy without entropy =      -16.55264453  energy(sigma->0) =      -16.55839093
  energy without entropy =      -16.55264636  energy(sigma->0) =      -16.55839278
  energy without entropy =      -16.55264568  energy(sigma->0) =      -16.55839193
  energy without entropy =      -16.55263224  energy(sigma->0) =      -16.55837499
  energy without entropy =      -16.55263933  energy(sigma->0) =      -16.55838300
  energy without entropy =      -16.55263798  energy(sigma->0) =      -16.55837969
  energy without entropy =      -16.55264546  energy(sigma->0) =      -16.55838810
  energy without entropy =      -16.55264875  energy(sigma->0) =      -16.55839052
  energy without entropy =      -16.55264764  energy(sigma->0) =      -16.55838562
  energy without entropy =      -16.55266120  energy(sigma->0) =      -16.55839898
  energy without entropy =      -16.55265671  energy(sigma->0) =      -16.55839352
  energy without entropy =      -16.55266083  energy(sigma->0) =      -16.55839815
  energy without entropy =      -16.55266250  energy(sigma->0) =      -16.55840006
  energy without entropy =      -16.55266087  energy(sigma->0) =      -16.55839818
  energy without entropy =      -16.55266962  energy(sigma->0) =      -16.55840822
  energy without entropy =      -16.55268735  energy(sigma->0) =      -16.55842648
  energy without entropy =      -16.55268869  energy(sigma->0) =      -16.55842760
 E-fermi :  -4.8421     XC(G=0):  -6.0368     alpha+bet : -5.2043
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.56744099  energy(sigma->0) =      -16.57306588
  energy without entropy =      -16.56744099  energy(sigma->0) =      -16.57306588
  energy without entropy =      -16.56744100  energy(sigma->0) =      -16.57306588
  energy without entropy =      -16.56744100  energy(sigma->0) =      -16.57306588
  energy without entropy =      -16.56744100  energy(sigma->0) =      -16.57306588
  energy without entropy =      -16.56755301  energy(sigma->0) =      -16.57321592
  energy without entropy =      -16.56756761  energy(sigma->0) =      -16.57323045
  energy without entropy =      -16.56756369  energy(sigma->0) =      -16.57322601
  energy without entropy =      -16.56754617  energy(sigma->0) =      -16.57320810
  energy without entropy =      -16.56754562  energy(sigma->0) =      -16.57320737
 E-fermi :  -4.7922     XC(G=0):  -6.0950     alpha+bet : -5.2044
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.58215411  energy(sigma->0) =      -16.58769885
  energy without entropy =      -16.58215411  energy(sigma->0) =      -16.58769885
  energy without entropy =      -16.58215411  energy(sigma->0) =      -16.58769885
  energy without entropy =      -16.58215411  energy(sigma->0) =      -16.58769885
  energy without entropy =      -16.58215411  energy(sigma->0) =      -16.58769885
  energy without entropy =      -16.58262672  energy(sigma->0) =      -16.58820263
  energy without entropy =      -16.58262997  energy(sigma->0) =      -16.58820582
  energy without entropy =      -16.58263024  energy(sigma->0) =      -16.58820614
 E-fermi :  -4.7412     XC(G=0):  -6.1245     alpha+bet : -5.2045
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.59182800  energy(sigma->0) =      -16.59732779
  energy without entropy =      -16.59182800  energy(sigma->0) =      -16.59732779
  energy without entropy =      -16.59182800  energy(sigma->0) =      -16.59732779
  energy without entropy =      -16.59182800  energy(sigma->0) =      -16.59732779
  energy without entropy =      -16.59182800  energy(sigma->0) =      -16.59732779
  energy without entropy =      -16.59238318  energy(sigma->0) =      -16.59790064
  energy without entropy =      -16.59237903  energy(sigma->0) =      -16.59789636
  energy without entropy =      -16.59234706  energy(sigma->0) =      -16.59786331
  energy without entropy =      -16.59227897  energy(sigma->0) =      -16.59779284
  energy without entropy =      -16.59219429  energy(sigma->0) =      -16.59770436
  energy without entropy =      -16.59220186  energy(sigma->0) =      -16.59771217
  energy without entropy =      -16.59210872  energy(sigma->0) =      -16.59761559
  energy without entropy =      -16.59209605  energy(sigma->0) =      -16.59760273
  energy without entropy =      -16.59206783  energy(sigma->0) =      -16.59757352
  energy without entropy =      -16.59206318  energy(sigma->0) =      -16.59756865
  energy without entropy =      -16.59188849  energy(sigma->0) =      -16.59738808
  energy without entropy =      -16.59187885  energy(sigma->0) =      -16.59737794
  energy without entropy =      -16.59188325  energy(sigma->0) =      -16.59738248
  energy without entropy =      -16.59188353  energy(sigma->0) =      -16.59738277
 E-fermi :  -4.7181     XC(G=0):  -6.1284     alpha+bet : -5.2046
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.59550611  energy(sigma->0) =      -16.60097518
  energy without entropy =      -16.59550611  energy(sigma->0) =      -16.60097518
  energy without entropy =      -16.59550611  energy(sigma->0) =      -16.60097518
  energy without entropy =      -16.59550611  energy(sigma->0) =      -16.60097518
  energy without entropy =      -16.59550611  energy(sigma->0) =      -16.60097518
  energy without entropy =      -16.59570467  energy(sigma->0) =      -16.60118052
  energy without entropy =      -16.59581903  energy(sigma->0) =      -16.60129913
  energy without entropy =      -16.59584071  energy(sigma->0) =      -16.60132131
  energy without entropy =      -16.59580864  energy(sigma->0) =      -16.60128796
  energy without entropy =      -16.59577622  energy(sigma->0) =      -16.60125268
  energy without entropy =      -16.59548022  energy(sigma->0) =      -16.60094209
  energy without entropy =      -16.59529879  energy(sigma->0) =      -16.60074663
  energy without entropy =      -16.59525036  energy(sigma->0) =      -16.60069279
  energy without entropy =      -16.59524292  energy(sigma->0) =      -16.60068442
  energy without entropy =      -16.59523684  energy(sigma->0) =      -16.60067794
  energy without entropy =      -16.59522117  energy(sigma->0) =      -16.60066113
  energy without entropy =      -16.59524391  energy(sigma->0) =      -16.60068679
  energy without entropy =      -16.59524634  energy(sigma->0) =      -16.60068943
  energy without entropy =      -16.59523333  energy(sigma->0) =      -16.60067522
  energy without entropy =      -16.59524864  energy(sigma->0) =      -16.60069124
  energy without entropy =      -16.59524983  energy(sigma->0) =      -16.60069250
  energy without entropy =      -16.59529618  energy(sigma->0) =      -16.60074483
  energy without entropy =      -16.59529940  energy(sigma->0) =      -16.60074832
  energy without entropy =      -16.59528406  energy(sigma->0) =      -16.60073212
  energy without entropy =      -16.59530276  energy(sigma->0) =      -16.60075120
  energy without entropy =      -16.59532009  energy(sigma->0) =      -16.60076922
  energy without entropy =      -16.59524886  energy(sigma->0) =      -16.60068999
  energy without entropy =      -16.59523670  energy(sigma->0) =      -16.60067537
  energy without entropy =      -16.59520969  energy(sigma->0) =      -16.60064419
  energy without entropy =      -16.59518930  energy(sigma->0) =      -16.60062122
  energy without entropy =      -16.59518325  energy(sigma->0) =      -16.60061542
  energy without entropy =      -16.59511989  energy(sigma->0) =      -16.60054827
  energy without entropy =      -16.59511274  energy(sigma->0) =      -16.60053914
  energy without entropy =      -16.59510831  energy(sigma->0) =      -16.60053388
  energy without entropy =      -16.59510821  energy(sigma->0) =      -16.60053360
 E-fermi :  -4.7247     XC(G=0):  -6.0751     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60031713  energy(sigma->0) =      -16.60570047
  energy without entropy =      -16.60031714  energy(sigma->0) =      -16.60570048
  energy without entropy =      -16.60031714  energy(sigma->0) =      -16.60570048
  energy without entropy =      -16.60031714  energy(sigma->0) =      -16.60570048
  energy without entropy =      -16.60031714  energy(sigma->0) =      -16.60570048
  energy without entropy =      -16.60043847  energy(sigma->0) =      -16.60583163
  energy without entropy =      -16.60103473  energy(sigma->0) =      -16.60646879
  energy without entropy =      -16.60103743  energy(sigma->0) =      -16.60647111
  energy without entropy =      -16.60103432  energy(sigma->0) =      -16.60646804
  energy without entropy =      -16.60102393  energy(sigma->0) =      -16.60645725
  energy without entropy =      -16.60097730  energy(sigma->0) =      -16.60640884
  energy without entropy =      -16.60103320  energy(sigma->0) =      -16.60646718
  energy without entropy =      -16.60103333  energy(sigma->0) =      -16.60646724
 E-fermi :  -4.6919     XC(G=0):  -6.1397     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.59838573  energy(sigma->0) =      -16.60384197
  energy without entropy =      -16.59838573  energy(sigma->0) =      -16.60384197
  energy without entropy =      -16.59838573  energy(sigma->0) =      -16.60384197
  energy without entropy =      -16.59838573  energy(sigma->0) =      -16.60384197
  energy without entropy =      -16.59838573  energy(sigma->0) =      -16.60384197
  energy without entropy =      -16.59822702  energy(sigma->0) =      -16.60367892
  energy without entropy =      -16.59835500  energy(sigma->0) =      -16.60381407
  energy without entropy =      -16.59837061  energy(sigma->0) =      -16.60382936
  energy without entropy =      -16.59826973  energy(sigma->0) =      -16.60372546
  energy without entropy =      -16.59812724  energy(sigma->0) =      -16.60357818
  energy without entropy =      -16.59810231  energy(sigma->0) =      -16.60355258
  energy without entropy =      -16.59811634  energy(sigma->0) =      -16.60356689
  energy without entropy =      -16.59794009  energy(sigma->0) =      -16.60338180
  energy without entropy =      -16.59776563  energy(sigma->0) =      -16.60319861
  energy without entropy =      -16.59778538  energy(sigma->0) =      -16.60321958
  energy without entropy =      -16.59779719  energy(sigma->0) =      -16.60323201
  energy without entropy =      -16.59778016  energy(sigma->0) =      -16.60321376
  energy without entropy =      -16.59768448  energy(sigma->0) =      -16.60311181
  energy without entropy =      -16.59777195  energy(sigma->0) =      -16.60320489
  energy without entropy =      -16.59780138  energy(sigma->0) =      -16.60323559
  energy without entropy =      -16.59773454  energy(sigma->0) =      -16.60316460
  energy without entropy =      -16.59771707  energy(sigma->0) =      -16.60314560
  energy without entropy =      -16.59763613  energy(sigma->0) =      -16.60305685
  energy without entropy =      -16.59747990  energy(sigma->0) =      -16.60288695
  energy without entropy =      -16.59747013  energy(sigma->0) =      -16.60287345
  energy without entropy =      -16.59747189  energy(sigma->0) =      -16.60287114
  energy without entropy =      -16.59746201  energy(sigma->0) =      -16.60286023
  energy without entropy =      -16.59745860  energy(sigma->0) =      -16.60285637
  energy without entropy =      -16.59741343  energy(sigma->0) =      -16.60280092
  energy without entropy =      -16.59741506  energy(sigma->0) =      -16.60280403
  energy without entropy =      -16.59742650  energy(sigma->0) =      -16.60281807
  energy without entropy =      -16.59742619  energy(sigma->0) =      -16.60281758
 E-fermi :  -4.7194     XC(G=0):  -6.0800     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60135615  energy(sigma->0) =      -16.60671588
  energy without entropy =      -16.60135615  energy(sigma->0) =      -16.60671588
  energy without entropy =      -16.60135615  energy(sigma->0) =      -16.60671588
  energy without entropy =      -16.60135615  energy(sigma->0) =      -16.60671588
  energy without entropy =      -16.60135615  energy(sigma->0) =      -16.60671588
  energy without entropy =      -16.60136981  energy(sigma->0) =      -16.60673744
  energy without entropy =      -16.60144833  energy(sigma->0) =      -16.60682736
  energy without entropy =      -16.60145099  energy(sigma->0) =      -16.60683052
  energy without entropy =      -16.60148043  energy(sigma->0) =      -16.60686085
  energy without entropy =      -16.60147103  energy(sigma->0) =      -16.60685057
  energy without entropy =      -16.60145371  energy(sigma->0) =      -16.60683138
  energy without entropy =      -16.60147044  energy(sigma->0) =      -16.60684147
  energy without entropy =      -16.60146626  energy(sigma->0) =      -16.60683635
  energy without entropy =      -16.60140824  energy(sigma->0) =      -16.60677225
  energy without entropy =      -16.60141421  energy(sigma->0) =      -16.60677580
  energy without entropy =      -16.60137703  energy(sigma->0) =      -16.60672784
  energy without entropy =      -16.60200337  energy(sigma->0) =      -16.60741820
  energy without entropy =      -16.60187556  energy(sigma->0) =      -16.60728429
  energy without entropy =      -16.60187454  energy(sigma->0) =      -16.60728332
 E-fermi :  -4.6912     XC(G=0):  -6.1234     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.59906343  energy(sigma->0) =      -16.60449568
  energy without entropy =      -16.59906343  energy(sigma->0) =      -16.60449568
  energy without entropy =      -16.59906343  energy(sigma->0) =      -16.60449568
  energy without entropy =      -16.59906343  energy(sigma->0) =      -16.60449568
  energy without entropy =      -16.59906343  energy(sigma->0) =      -16.60449568
  energy without entropy =      -16.59893214  energy(sigma->0) =      -16.60435760
  energy without entropy =      -16.59875852  energy(sigma->0) =      -16.60417688
  energy without entropy =      -16.59871573  energy(sigma->0) =      -16.60412843
  energy without entropy =      -16.59870669  energy(sigma->0) =      -16.60411773
  energy without entropy =      -16.59870263  energy(sigma->0) =      -16.60411340
  energy without entropy =      -16.59869540  energy(sigma->0) =      -16.60410527
  energy without entropy =      -16.59861138  energy(sigma->0) =      -16.60401226
  energy without entropy =      -16.59853342  energy(sigma->0) =      -16.60392341
  energy without entropy =      -16.59852973  energy(sigma->0) =      -16.60391784
  energy without entropy =      -16.59852939  energy(sigma->0) =      -16.60391762
 E-fermi :  -4.7124     XC(G=0):  -6.0791     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60078865  energy(sigma->0) =      -16.60615862
  energy without entropy =      -16.60078865  energy(sigma->0) =      -16.60615862
  energy without entropy =      -16.60078865  energy(sigma->0) =      -16.60615862
  energy without entropy =      -16.60078865  energy(sigma->0) =      -16.60615862
  energy without entropy =      -16.60078865  energy(sigma->0) =      -16.60615862
  energy without entropy =      -16.60079950  energy(sigma->0) =      -16.60617223
  energy without entropy =      -16.60084014  energy(sigma->0) =      -16.60622539
  energy without entropy =      -16.60089513  energy(sigma->0) =      -16.60628342
  energy without entropy =      -16.60088520  energy(sigma->0) =      -16.60627292
  energy without entropy =      -16.60088337  energy(sigma->0) =      -16.60627191
 E-fermi :  -4.7015     XC(G=0):  -6.1091     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60051443  energy(sigma->0) =      -16.60590599
  energy without entropy =      -16.60051443  energy(sigma->0) =      -16.60590600
  energy without entropy =      -16.60051443  energy(sigma->0) =      -16.60590600
  energy without entropy =      -16.60051443  energy(sigma->0) =      -16.60590599
  energy without entropy =      -16.60051443  energy(sigma->0) =      -16.60590599
  energy without entropy =      -16.60051244  energy(sigma->0) =      -16.60590140
  energy without entropy =      -16.60044047  energy(sigma->0) =      -16.60582496
  energy without entropy =      -16.60033428  energy(sigma->0) =      -16.60570271
  energy without entropy =      -16.60036725  energy(sigma->0) =      -16.60573839
  energy without entropy =      -16.60036378  energy(sigma->0) =      -16.60573372
  energy without entropy =      -16.60036390  energy(sigma->0) =      -16.60573399
 E-fermi :  -4.7169     XC(G=0):  -6.0954     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60370380  energy(sigma->0) =      -16.60904690
  energy without entropy =      -16.60370381  energy(sigma->0) =      -16.60904690
  energy without entropy =      -16.60370381  energy(sigma->0) =      -16.60904690
  energy without entropy =      -16.60370381  energy(sigma->0) =      -16.60904690
  energy without entropy =      -16.60370381  energy(sigma->0) =      -16.60904690
  energy without entropy =      -16.60374400  energy(sigma->0) =      -16.60909669
  energy without entropy =      -16.60375620  energy(sigma->0) =      -16.60911115
  energy without entropy =      -16.60376145  energy(sigma->0) =      -16.60911687
  energy without entropy =      -16.60376953  energy(sigma->0) =      -16.60912646
  energy without entropy =      -16.60378730  energy(sigma->0) =      -16.60914213
  energy without entropy =      -16.60376059  energy(sigma->0) =      -16.60910930
  energy without entropy =      -16.60374425  energy(sigma->0) =      -16.60909082
  energy without entropy =      -16.60373086  energy(sigma->0) =      -16.60907467
  energy without entropy =      -16.60374026  energy(sigma->0) =      -16.60908445
  energy without entropy =      -16.60371728  energy(sigma->0) =      -16.60905296
  energy without entropy =      -16.60372917  energy(sigma->0) =      -16.60906657
  energy without entropy =      -16.60374602  energy(sigma->0) =      -16.60907803
  energy without entropy =      -16.60375366  energy(sigma->0) =      -16.60908354
  energy without entropy =      -16.60375112  energy(sigma->0) =      -16.60907863
  energy without entropy =      -16.60378658  energy(sigma->0) =      -16.60911947
  energy without entropy =      -16.60382203  energy(sigma->0) =      -16.60916064
  energy without entropy =      -16.60382915  energy(sigma->0) =      -16.60917038
  energy without entropy =      -16.60382810  energy(sigma->0) =      -16.60916767
  energy without entropy =      -16.60382514  energy(sigma->0) =      -16.60916363
  energy without entropy =      -16.60383615  energy(sigma->0) =      -16.60917682
  energy without entropy =      -16.60383974  energy(sigma->0) =      -16.60918068
  energy without entropy =      -16.60401696  energy(sigma->0) =      -16.60939103
  energy without entropy =      -16.60402704  energy(sigma->0) =      -16.60940052
  energy without entropy =      -16.60402524  energy(sigma->0) =      -16.60939867
  energy without entropy =      -16.60401295  energy(sigma->0) =      -16.60938523
  energy without entropy =      -16.60402243  energy(sigma->0) =      -16.60939540
  energy without entropy =      -16.60393479  energy(sigma->0) =      -16.60930131
  energy without entropy =      -16.60391378  energy(sigma->0) =      -16.60927890
  energy without entropy =      -16.60387056  energy(sigma->0) =      -16.60923174
  energy without entropy =      -16.60389082  energy(sigma->0) =      -16.60925269
  energy without entropy =      -16.60386291  energy(sigma->0) =      -16.60922136
  energy without entropy =      -16.60379607  energy(sigma->0) =      -16.60911785
  energy without entropy =      -16.60382200  energy(sigma->0) =      -16.60913843
  energy without entropy =      -16.60382928  energy(sigma->0) =      -16.60914635
  energy without entropy =      -16.60383945  energy(sigma->0) =      -16.60915584
  energy without entropy =      -16.60384058  energy(sigma->0) =      -16.60915925
  energy without entropy =      -16.60383901  energy(sigma->0) =      -16.60915435
  energy without entropy =      -16.60383929  energy(sigma->0) =      -16.60915300
  energy without entropy =      -16.60383898  energy(sigma->0) =      -16.60915237
 E-fermi :  -4.7175     XC(G=0):  -5.9624     alpha+bet : -5.2047
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60732453  energy(sigma->0) =      -16.61261054
  energy without entropy =      -16.60732454  energy(sigma->0) =      -16.61261055
  energy without entropy =      -16.60732454  energy(sigma->0) =      -16.61261055
  energy without entropy =      -16.60732454  energy(sigma->0) =      -16.61261055
  energy without entropy =      -16.60732454  energy(sigma->0) =      -16.61261055
  energy without entropy =      -16.60730088  energy(sigma->0) =      -16.61259599
  energy without entropy =      -16.60731650  energy(sigma->0) =      -16.61260634
  energy without entropy =      -16.60732762  energy(sigma->0) =      -16.61261327
  energy without entropy =      -16.60732979  energy(sigma->0) =      -16.61261338
  energy without entropy =      -16.60733039  energy(sigma->0) =      -16.61261360
 E-fermi :  -4.7085     XC(G=0):  -5.8754     alpha+bet : -5.2048
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60865586  energy(sigma->0) =      -16.61392868
  energy without entropy =      -16.60865587  energy(sigma->0) =      -16.61392869
  energy without entropy =      -16.60865587  energy(sigma->0) =      -16.61392869
  energy without entropy =      -16.60865587  energy(sigma->0) =      -16.61392869
  energy without entropy =      -16.60865587  energy(sigma->0) =      -16.61392869
  energy without entropy =      -16.60864987  energy(sigma->0) =      -16.61392465
  energy without entropy =      -16.60865754  energy(sigma->0) =      -16.61392865
 E-fermi :  -4.7056     XC(G=0):  -5.8734     alpha+bet : -5.2048
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy without entropy =      -16.60928572  energy(sigma->0) =      -16.61455191
  energy without entropy =      -16.60928572  energy(sigma->0) =      -16.61455191
  energy without entropy =      -16.60928572  energy(sigma->0) =      -16.61455191
  energy without entropy =      -16.60928572  energy(sigma->0) =      -16.61455191
  energy without entropy =      -16.60928572  energy(sigma->0) =      -16.61455191
  energy without entropy =      -16.60928119  energy(sigma->0) =      -16.61454974
 E-fermi :  -4.7024     XC(G=0):  -5.8853     alpha+bet : -5.2048
------------------------ aborting loop because EDIFF is reached ----------------------------------------
  energy  without entropy=      -16.60928119  energy(sigma->0) =      -16.61454974
 General timing and accounting informations for this job:
