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LCPQ
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quack
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https://github.com/pfloos/quack
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2024-12-23 04:43:53 +01:00
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95e10e2ee8
quack
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input
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basis
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shuffle SCF
2020-03-30 17:50:07 +02:00
1 1
makefile
2020-03-27 09:04:56 +01:00
S 3
shuffle SCF
2020-03-30 17:50:07 +02:00
1 3.42525091 0.15432897
2 0.62391373 0.53532814
3 0.16885540 0.44463454
2 1
S 3
1 3.42525091 0.15432897
2 0.62391373 0.53532814
3 0.16885540 0.44463454
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