Marek Nečada
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84a2b7f64d
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Fix spherical harmonics for negative m in ewald.c.
Former-commit-id: 960dd721a009e2b2f82c986677c3faa65d36394c
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2018-09-10 15:28:41 +03:00 |
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Marek Nečada
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663a5915dd
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Print csphase in test output
Former-commit-id: 6cfd97014efd971a64f71c180f30260137a8e2f7
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2018-09-10 13:02:12 +03:00 |
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Marek Nečada
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0426524842
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konstantisace; dudopráce
Former-commit-id: a146fe83f9dbf17044cc723c325ba70230969e44
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2018-09-10 05:10:13 +00:00 |
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Marek Nečada
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bad8105c9b
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Fix legendre function indexing. Test pass for even m now.
Former-commit-id: 2bd5bfddc3eab30a0e1e7590d18f31bf5098d54e
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2018-09-07 20:11:50 +00:00 |
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Marek Nečada
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1fca413cab
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Catch underflows; fix some off-by-one errors. Some test values pass now.
Former-commit-id: 3add9f21ad6fee5d443fafc3a6b2c02f2f8b6524
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2018-09-07 17:46:07 +00:00 |
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Marek Nečada
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fd6380a085
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Found some memory-related bug
Former-commit-id: 684f9cbe9f7f8112aff5981215076182051c8235
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2018-09-06 16:17:28 +03:00 |
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Marek Nečada
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5357d53fc5
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Fix ewalds.c test output; n.b. the current long-range parts.
Former-commit-id: f51675842d53a2ba0c6c2821180c11fe60445257
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2018-09-06 15:00:38 +03:00 |
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Marek Nečada
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adc731029e
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More test params etc. (still wrong results)
Former-commit-id: 589f4a643ac318f384554b83318355289fdf827d
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2018-09-05 19:45:28 +00:00 |
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Marek Nečada
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d69bd91356
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Ewald test fixes.
Former-commit-id: e39e837ac508c89b771e6f96b1fb244f2b7b2e05
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2018-09-05 19:07:41 +00:00 |
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Marek Nečada
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b707f65d83
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Ewald sum first test compiles
Former-commit-id: bb63ffdade407900478c26f2e10bc0ee8efb5154
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2018-09-05 18:50:02 +00:00 |
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Marek Nečada
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e11f995b52
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Scalar m,n indexing to allow n = 0.
Former-commit-id: 4b6f2f3611a00e2019b54bfe73c407baafdd8355
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2018-09-05 12:39:02 +00:00 |