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scitas-examples/Modules/vasp/test/POSCAR
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POSCAR
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Al(111) 3x3x4 surface atop adsorption
2.86378246400000
2.0000000000000000 0.0000000000000000 0.0000000000000000
1.0000000000000000 1.7320508073333334 0.0000000000000000
0.0000000000000000 0.0000000000000000 9.0000000000000000
20 1
Selective dynamics
Direct
0.1666666666666643 0.1666666666666643 0.0070989999999895 F F F
0.1666666666666643 0.6666666666666643 0.0070989999999895 F F F
0.6666666666666643 0.1666666666666643 0.0070989999999895 F F F
0.6666666666666643 0.6666666666666643 0.0070989999999895 F F F
0.0000000000000000 0.0000000000000000 0.0978329999999943 F F F
0.0000000000000000 0.4999949999999984 0.0978329999999943 F F F
0.4999949999999984 0.0000000000000000 0.0978329999999943 F F F
0.4999949999999984 0.4999949999999984 0.0978329999999943 F F F
0.3333109408679693 0.3333113391763535 0.1887264807843667 T T T
0.3332994232483916 0.8333192399548913 0.1902042599884427 T T T
0.8333187704015027 0.3332999206619586 0.1902042441904022 T T T
0.8333191169191860 0.8333196413674165 0.1902027053496346 T T T
0.1689367409182012 0.1689369949957954 0.2812387108349965 T T T
0.1689327899754632 0.6620706698440938 0.2812376962128139 T T T
0.6620705890356507 0.1689330482360467 0.2812376887930492 T T T
0.6666456259933539 0.6666458108637592 0.2805457709699051 T T T
0.9999934354082093 0.9999933309197788 0.3671959586265979 T T T
0.9890011833235706 0.5054846357100458 0.3755067082334778 T T T
0.5054850132452869 0.9890010820778177 0.3755066560218892 T T T
0.5054772391607064 0.5054771924750909 0.3755059367703729 T T T
0.3333301021889812 0.3333298016608128 0.4048060038925952 T T T
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
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0.00000000E+00 0.00000000E+00 0.00000000E+00
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0.00000000E+00 0.00000000E+00 0.00000000E+00
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0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
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