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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36
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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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-25.3318804992
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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 0.000214766467 0 0 1
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Image: 2
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-25.3341882697
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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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1.391811609956 1.391811609956 2.494265914274 -0.000000000000 -0.000000000000 -0.000269338923
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Image: 3
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-25.3307258489
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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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2.705568402496 2.705568402496 1.538414289047 0.000000000000 0.000000000000 0.000839322037
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Image: 4
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-25.3341882680
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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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4.019327602186 4.019327602186 2.494266302195 0.000000000000 0.000000000000 -0.000269358293
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Image: 5
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-25.3318804972
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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 0.000215554624
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