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3f0dbfc928
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Parallelized ERI with Domainslib
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2023-06-16 18:27:23 +02:00 |
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9d3f1ef05a
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Modifs for M1
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2022-12-13 10:55:47 +01:00 |
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98ca250ed3
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Summary
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2021-10-19 16:57:22 +02:00 |
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0b6fe42e55
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Localization
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2021-01-30 19:07:59 +01:00 |
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8502befb65
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Update documentation
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2021-01-28 00:34:26 +01:00 |
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d0f61750da
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Add Gaussian.Atomic_shell_pair
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2021-01-20 23:55:34 +01:00 |
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d1a0145826
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Atomic shell pair couple org
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2021-01-07 09:21:06 +01:00 |
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d2b4928352
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Added gaussian basis
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2021-01-04 23:38:02 +01:00 |
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fccf76180e
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Improved Makefile
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2021-01-01 18:07:06 +01:00 |
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08bd5303d9
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Added HTML documentation
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2021-01-01 17:05:25 +01:00 |
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73a5cf6ca2
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MP2 OK
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2021-01-01 16:39:33 +01:00 |
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