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auxbasis
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inital commit for quack
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2019-02-07 22:49:12 +01:00 |
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basis
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debug pCCD
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2020-03-22 15:20:42 +01:00 |
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dft
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moved Cx in parameters
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2020-03-18 16:06:29 +01:00 |
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geminal
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MCQC under serious work
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2019-03-13 16:15:53 +01:00 |
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int
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CCD is working
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2019-03-16 14:09:42 +01:00 |
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methods
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debug pCCD
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2020-03-22 15:20:42 +01:00 |
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molecule
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debug pCCD
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2020-03-22 15:20:42 +01:00 |
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molecule.xyz
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debug pCCD
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2020-03-22 15:20:42 +01:00 |
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options
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numgrid
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2020-03-21 16:31:39 +01:00 |
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sph
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adding files
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2019-05-07 22:57:57 +02:00 |
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weight
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debug pCCD
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2020-03-22 15:20:42 +01:00 |
