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c66ca60f65
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rename kw to k in improper-umbrella.yaml
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2025-02-11 15:53:14 +02:00 |
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94dd03d43c
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rename kw to k in improper_umbrella.cpp
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2025-02-11 15:52:20 +02:00 |
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5032436312
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Update fix_adapt.rst
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2025-02-11 15:49:46 +02:00 |
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c9b4689167
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rename sign and multiplicity in improper-cvff.yaml
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2025-02-11 15:48:50 +02:00 |
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bac4eec31b
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rename sign and multplicity in improper_cvff.cpp
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2025-02-11 15:47:58 +02:00 |
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a320a52804
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Update fix_adapt.rst
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2025-02-11 15:44:55 +02:00 |
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11b95655f8
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rename k0 to k in improper-class2.yaml
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2025-02-11 15:42:30 +02:00 |
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7e0f067b74
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rename k0 to k in improper_class2.cpp
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2025-02-11 15:41:22 +02:00 |
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18cd31d811
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Update fix_adapt.rst
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2025-02-10 20:22:32 +02:00 |
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e88946935c
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rename chi to theta0 in extract improper_ring.cpp
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2025-02-10 20:19:13 +02:00 |
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dc83bd3084
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rename chi to theta0 in improper-ring.yaml
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2025-02-10 20:18:13 +02:00 |
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7ae9ef75d8
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Update fix_adapt.rst
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2025-02-10 19:20:26 +02:00 |
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70acd78048
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change chi to d0 in improper_distharm.cpp
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2025-02-10 19:18:58 +02:00 |
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f738690cb5
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change chi to d0 in improper_distharm.h
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2025-02-10 19:16:47 +02:00 |
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2b46abc31c
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change chi to d0 in improper-distharm.yaml
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2025-02-10 19:15:58 +02:00 |
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0c80ec5e0d
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change chi to chi0 in improper_harmonic_kokkos.cpp
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2025-02-10 19:06:14 +02:00 |
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3f5c54e362
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change chi to chi0 in improper_harmonic_omp.cpp
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2025-02-10 19:00:55 +02:00 |
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7fe804d19d
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change chi to chi0 in improper_cossq_omp.cpp
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2025-02-10 19:00:21 +02:00 |
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5251ba1465
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change chi to chi0 in fix_adapt.rst
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2025-02-10 18:45:40 +02:00 |
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e90d5133cc
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change chi to chi0 in improper_cossq.cpp
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2025-02-10 18:44:40 +02:00 |
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9bce6662b4
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change chi to chi0 in improper_cossq.h
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2025-02-10 18:42:55 +02:00 |
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8dfb967acc
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change chi to chi0 in improper-cossq.yaml
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2025-02-10 18:42:07 +02:00 |
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261cc13f99
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Update fix_adapt.rst
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2025-02-10 18:39:13 +02:00 |
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f6e39d14b0
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change chi to chi0 in improper_harmonic.cpp
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2025-02-10 18:37:47 +02:00 |
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ec0afc3fdf
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change chi to chi0 in improper_harmonic.h
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2025-02-10 18:35:37 +02:00 |
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6abdedc75b
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change chi to chi0 in improper-harmonic.yaml
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2025-02-10 18:34:15 +02:00 |
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7cf3ff588e
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include table with impropers in fix_adapt.rst
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2025-02-09 16:54:15 +02:00 |
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d11c8b3e1e
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Update text for improper style in fix_adapt.rst
Update text though a table with the potentials is not included
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2025-02-09 15:08:02 +02:00 |
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fe3c8487de
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implement check_itype in improper_hybrid.cpp
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2025-02-09 14:48:10 +02:00 |
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c0ef702af5
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define chech_itype in improper_hybrid.h
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2025-02-09 14:46:18 +02:00 |
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f7a43b94a6
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fix error: ‘else’ without a previous ‘if’
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2025-02-09 14:39:48 +02:00 |
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e4a16556db
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implement the actual code to adapt improper parameters in fix_adapt.cpp
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2025-02-09 14:26:28 +02:00 |
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49b5e89258
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Update unit test in improper-fourier.yaml
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2025-02-08 19:06:08 +02:00 |
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e954bdfc14
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implement extract in improper_fourier.cpp
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2025-02-08 19:04:43 +02:00 |
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2a2a7a3113
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define extract in improper_fourier.h
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2025-02-08 19:01:56 +02:00 |
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66117414dd
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implement extract in improper_amoeba.cpp
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2025-02-08 18:56:38 +02:00 |
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38d28fb426
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define extract for improper amoeba
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2025-02-08 18:55:33 +02:00 |
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d384de354a
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Update unit test in improper-class2.yaml
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2025-02-07 09:31:28 +02:00 |
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26e1b5d101
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implement extract in improper_class2.cpp
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2025-02-07 09:29:41 +02:00 |
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909796b858
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define extract for improper class2
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2025-02-07 09:28:18 +02:00 |
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2440564bef
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Update unit test in improper-cossq.yaml
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2025-02-06 21:23:36 +02:00 |
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ced5fd3240
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Update unit test in improper-umbrella.yaml
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2025-02-06 21:22:05 +02:00 |
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c918c7b547
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Update unit test in improper-inversion_harmonic.yaml
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2025-02-06 21:20:41 +02:00 |
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f9b7013af3
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Update unit test in improper-sqdistharm.yaml
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2025-02-06 21:18:53 +02:00 |
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33f5057488
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Update unit test in improper-distance.yaml
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2025-02-06 21:17:27 +02:00 |
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22898fc8fc
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Update unit test in improper-distharm.yaml
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2025-02-06 21:16:33 +02:00 |
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72d2b70125
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Update unit test in improper-ring.yaml
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2025-02-06 21:15:28 +02:00 |
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61f4012300
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Update unit test in improper-harmonic.yaml
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2025-02-06 21:14:46 +02:00 |
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24f40c7db4
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Update unit test in improper-cvff.yaml
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2025-02-06 21:13:38 +02:00 |
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ea9166d175
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implement extract in improper distharm
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2025-02-06 17:24:52 +02:00 |
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