mirror of https://gitlab.com/QEF/q-e.git
50 lines
3.6 KiB
SYSTEMD
50 lines
3.6 KiB
SYSTEMD
RESTART INFORMATION
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28
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50
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0
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NUMBER OF IMAGES
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5
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APPLY CONSTANT BIAS
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T
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ENERGIES, POSITIONS AND GRADIENTS
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Image: 1
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-25.3319789669
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1.297850000000E+01 -1.833261050783E-01 1.011015146665E+02
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0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0 0 0
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5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0 0 0
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0.000000000000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0 0 0
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5.411138430000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0 0 0
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0.000000000000 0.000000000000 3.110553670000 0.000000000000 0.000000000000 0.000631181179 0 0 1
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Image: 2
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-25.3346662669
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1.296867726069E+01 -1.832374604274E-01 9.054637282797E+01
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0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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0.000000000000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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1.408059462417 1.408059462417 2.483054456076 0.000000000000 0.000000000000 0.000232657197
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Image: 3
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-25.3313468004
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1.296145981513E+01 -1.839777956212E-01 8.091732148132E+01
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0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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0.000000000000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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2.705591176411 2.705591176411 1.514419943508 0.000000000000 0.000000000000 0.000502575294
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Image: 4
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-25.3346664720
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1.296866905715E+01 -1.832454325917E-01 9.054373489574E+01
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0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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0.000000000000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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4.002951617057 4.002951617057 2.482941847868 0.000000000000 0.000000000000 0.000229680249
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Image: 5
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-25.3319766836
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1.297850000000E+01 -1.832316502891E-01 1.010103859608E+02
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0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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0.000000000000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 5.411138430000 0.000000000000 0.000000000000 0.000000000000 0.000000000000
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5.411138430000 5.411138430000 3.110553670000 0.000000000000 0.000000000000 0.000642149444
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