mirror of https://gitlab.com/QEF/q-e.git
43 lines
3.3 KiB
SYSTEMD
43 lines
3.3 KiB
SYSTEMD
RESTART INFORMATION
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22
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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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ENERGIES, POSITIONS AND GRADIENTS
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Image: 1
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-25.3319561397
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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 0.000124985487 0 0 1
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Image: 2
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-25.3342714238
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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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1.408097884909 1.408097884909 2.485146219228 -0.000000000000 -0.000000000000 0.000046365508
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Image: 3
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-25.3307257348
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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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2.705630417496 2.705630417496 1.488924769934 -0.000000000000 -0.000000000000 0.000122426828
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Image: 4
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-25.3343191563
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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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4.003318217983 4.003318217983 2.485389800742 0.000000000000 0.000000000000 -0.000001971189
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Image: 5
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-25.3319562145
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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 0.000118384137
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