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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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unrestricted f
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2020-09-28 22:24:02 +02:00 |
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dft
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update UGW
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2020-09-21 16:54:38 +02:00 |
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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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fix problem with individual energies
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2020-07-08 10:55:03 +02:00 |
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methods
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dipole and f OK
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2020-09-28 22:58:58 +02:00 |
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molecule
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unrestricted f
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2020-09-28 22:24:02 +02:00 |
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molecule.xyz
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unrestricted f
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2020-09-28 22:24:02 +02:00 |
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options
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dipole and f OK
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2020-09-28 22:58:58 +02:00 |
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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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update eDFT
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2020-09-15 10:40:51 +02:00 |
