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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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ca727440db
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Removing org-mode source
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2023-06-28 13:51:12 +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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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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3c77e8267d
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Fix leadz
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2023-04-20 10:55:32 +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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44e99fe252
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Fix for ocaml 4.14.0
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2022-12-12 18:16:17 +01:00 |
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9b5ca55bd8
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Fixed Tailcall
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2022-11-07 14:59:11 +01:00 |
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5b22c9fabd
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Fix tailcall bug
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2021-11-09 14:57:19 +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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d28be0df9f
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Added basis org
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2021-01-04 09:19:35 +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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92c23f042f
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Added simulation
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2021-01-01 11:52:08 +01:00 |
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aa40a995b2
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Cleaned examples
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2020-12-29 01:19:48 +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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ceca635621
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Added bin/tangle.sh
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2020-12-28 01:57:09 +01:00 |
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d2e7848de2
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Finished common in org-mode
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2020-12-28 01:24:15 +01:00 |
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36e7dbc7bd
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Shorter documentation
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2020-12-27 23:15:14 +01:00 |
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e7c9abd0d3
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Put description after type
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2020-12-27 17:38:12 +01:00 |
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c6b48bed35
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Coordinate org
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2020-12-27 17:25:04 +01:00 |
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8efb05beb9
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Added constants.org
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2020-12-27 16:55:53 +01:00 |
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0838da5bcc
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Added build_doc
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2020-12-27 16:36:25 +01:00 |
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5244b2dba8
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Command-line org
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2020-12-27 15:46:11 +01:00 |
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b08079c09d
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Added Charge.org
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2020-12-27 13:43:55 +01:00 |
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dfadaf14c1
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permtutations -> permutations
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2020-12-26 01:54:39 +01:00 |
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ebd753d48e
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Added org-mode files in common
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2020-12-26 01:47:55 +01:00 |
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4146264c2e
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Added exponential of matrix
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2020-12-17 19:52:09 +01:00 |
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718d39924f
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Provided example
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2020-10-19 18:33:02 +02:00 |
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084417669f
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Fixed exception
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2020-10-09 10:05:43 +02:00 |
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6217dc5a0a
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Removed Qcaml_ prefixes
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2020-10-09 09:47:57 +02:00 |
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c1433be7f8
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Pretty printers for basis
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2020-10-08 11:42:33 +02:00 |
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79f3b5ef10
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Added phantom types to matrices
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2020-10-02 18:55:19 +02:00 |
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58d4c2695a
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Initial new repo
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2020-09-26 12:02:53 +02:00 |
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