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744f2a0552
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Removing org-mode
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2024-01-17 14:24:28 +01:00 |
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c4b022aeee
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Remove org-mode
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2024-01-17 10:30:24 +01:00 |
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d53c0e6ea3
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Added Landmark profiler
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2023-06-30 12:22:26 +02:00 |
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d5a71707c8
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Improved parallel integrals
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2023-06-17 02:07:35 +02:00 |
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39cdbba97e
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Fixed Lazy
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2023-06-17 00:32:39 +02:00 |
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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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b4211b8d85
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Working on TREXIO basis
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2023-04-24 19:31:51 +02:00 |
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919a8cbdd5
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Changed streams to seq
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2023-04-24 13:05:01 +02:00 |
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dbbebea8d0
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Merge lpqsv26:~/tmpdir/QuAcK/qcaml-tools/qcaml into dev
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2022-11-07 11:27:34 +01:00 |
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a692242b51
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Improved reading basis
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2022-11-07 11:24:20 +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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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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934d3de77a
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Atomic shell in org
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2021-01-06 09:03:26 +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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65d04a76f2
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Cleaned readme for auto-generation
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2020-12-28 12:23:39 +01:00 |
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62eacf4146
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Renamed Gaussian_basis into Gaussian
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2020-10-10 10:59:09 +02:00 |
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