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PTEROSOR
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QuAcK
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https://github.com/pfloos/quack
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a8d26d6e36
QuAcK
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input
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molecule.xyz
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CCD variants
2020-03-21 22:50:43 +01:00
1
examples
2020-01-17 17:35:40 +01:00
fix bug in eDFT
2020-03-23 08:53:19 +01:00
He 0.0000000000 0.0000000000 0.0000000000
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