mirror of https://github.com/phonopy/phonopy.git
16 lines
697 B
Plaintext
16 lines
697 B
Plaintext
C O F K Ca
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1.0
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5.0841812300000004 0.0000000000000000 0.0000000000000000
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-2.5420906099999998 4.4030301100000004 0.0000000000000000
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0.0000000000000000 0.0000000000000000 4.4502724499999999
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C O F K Ca
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1 3 1 1 1
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Direct
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0.6666666700000000 0.3333333300000000 0.5000000000000000
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0.8134992200000000 0.6269984500000000 0.5000000000000000
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0.3730015500000000 0.1865007800000000 0.5000000000000000
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0.8134992200000000 0.1865007800000000 0.5000000000000000
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0.3333333300000000 0.6666666700000000 0.0000000000000000
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0.0000000000000000 0.0000000000000000 0.0000000000000000
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0.3333333300000000 0.6666666700000000 0.5000000000000000
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