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e774a725b9
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Merging org files
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2020-11-05 12:57:39 +01:00 |
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2467214b3a
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Introduced Gaussian basis functions
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2020-11-05 00:46:19 +01:00 |
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00a051af49
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Added const attributes
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2020-10-31 19:07:57 +01:00 |
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cd93e6dc91
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Merge branch 'main' of github.com:TREX-CoE/qmckl into main
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2020-10-31 19:01:37 +01:00 |
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d11bcab913
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Added a to_be_processes directory
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2020-10-31 19:01:26 +01:00 |
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7a5b5b096c
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Changed tabs into spaces
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2020-10-30 16:22:29 +01:00 |
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Anthony Scemama
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a62c762b05
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Update gh-pages.yml
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2020-10-29 01:14:47 +01:00 |
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2b6a96518d
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emacs26 in gh-pages
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2020-10-29 01:06:18 +01:00 |
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7e0a0425bc
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Change docs
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2020-10-29 01:02:44 +01:00 |
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e3754febfc
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Add gh-pages workflow
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2020-10-29 00:56:48 +01:00 |
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945d391f63
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Add publication of documentation on gh-pages
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2020-10-29 00:28:46 +01:00 |
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dbe5397653
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Add publication of documentation on gh-pages
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2020-10-29 00:21:22 +01:00 |
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7df788b42a
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Add publication of documentation on gh-pages
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2020-10-29 00:20:20 +01:00 |
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3aaaabfad3
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Added transa/transb in distances
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2020-10-28 20:19:07 +01:00 |
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8147ad22a7
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Optimizations in polynomials
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2020-10-28 19:28:27 +01:00 |
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abc0e6b5ab
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Optimized polynomials
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2020-10-27 17:35:49 +01:00 |
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1db7d327e7
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Syntax coloring in html
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2020-10-27 17:24:44 +01:00 |
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2cc816766f
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HTML Export file name
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2020-10-26 19:44:21 +01:00 |
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1a16defe35
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Precision in tests
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2020-10-26 19:41:07 +01:00 |
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a20394f636
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Indentation
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2020-10-26 19:36:25 +01:00 |
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d91cb765e3
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Tests in Fortran
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2020-10-26 19:33:31 +01:00 |
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4c7b2213f4
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Distance test in Fortran
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2020-10-26 18:24:23 +01:00 |
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f0c9226393
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Allow tests in fortran
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2020-10-26 16:51:16 +01:00 |
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8df6823f50
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Removed C interface from export
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2020-10-25 15:25:15 +01:00 |
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959d4d1110
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Added noexport
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2020-10-25 15:16:02 +01:00 |
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5e9e74f743
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Added polynomials
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2020-10-25 15:03:01 +01:00 |
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9fde54922e
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Added make doc
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2020-10-22 01:24:14 +02:00 |
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Anthony Scemama
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3286145e66
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Update README.org
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2020-10-22 00:51:32 +02:00 |
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150518aef0
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Added f90 example file
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2020-10-22 00:50:07 +02:00 |
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5f5465eaf9
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Merge tests into single exe
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2020-10-21 19:50:18 +02:00 |
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8c9a10cae6
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Fixing workflow with submodules
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2020-10-17 01:28:15 +02:00 |
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c0a21d568a
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Simplify makefile
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2020-10-17 01:20:11 +02:00 |
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3377b056df
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Added tests to CI
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2020-10-17 01:14:57 +02:00 |
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fe3f30ebba
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Introduced munit for testing
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2020-10-17 01:10:54 +02:00 |
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722d6dd540
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Make test
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2020-10-17 00:28:49 +02:00 |
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456c6fc100
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Updated Makefile
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2020-10-17 00:00:57 +02:00 |
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97cfd4d2b5
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Added qmckl_malloc
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2020-10-16 23:59:14 +02:00 |
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ec7df80028
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Add tag to check if memory pointers are valid
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2020-10-16 23:38:35 +02:00 |
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87cfdc88d3
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updated tests, but tests fail
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2020-10-16 19:52:11 +02:00 |
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b310ae8638
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Merge branch 'main' of github.com:TREX-CoE/qmckl into main
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2020-10-16 19:42:27 +02:00 |
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534e11cccb
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Added tests
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2020-10-16 19:42:12 +02:00 |
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Anthony Scemama
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9e5b2b4fa5
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Update README.md
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2020-10-16 18:32:25 +02:00 |
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Anthony Scemama
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795803ef84
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Update README.md
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2020-10-16 18:31:07 +02:00 |
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Anthony Scemama
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db931247fb
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Update README.md
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2020-10-16 18:30:36 +02:00 |
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1879d3a67c
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Added coding style
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2020-10-16 18:29:21 +02:00 |
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55676a9002
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Moved Wiki documentation into the project
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2020-10-16 18:28:00 +02:00 |
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3a3ea1b8fe
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Moved Wiki documentation into the project
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2020-10-16 18:24:32 +02:00 |
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4236b33a4f
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Worked on Makefiles
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2020-10-16 13:58:05 +02:00 |
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vijay
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0c08855271
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Merge pull request #1 from TREX-CoE/main
Merge with main of TREX-CoE
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2020-10-15 21:13:51 +02:00 |
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32d633bfb6
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Fixed type in free
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2020-10-15 12:36:52 +02:00 |
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