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Basis_lexer.mll
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Reading both XYZ and Zmatrix
|
2018-01-17 15:56:57 +01:00 |
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Basis.ml
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Inserted overlap
|
2018-01-22 23:19:24 +01:00 |
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Basis.mli
|
Inserted overlap
|
2018-01-22 23:19:24 +01:00 |
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Contracted_shell.ml
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Optimization
|
2018-02-02 01:25:10 +01:00 |
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ERI.ml
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Merge branch 'tuples'
|
2018-02-03 18:39:14 +01:00 |
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Gamess_parser.mly
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Optimized ERIs
|
2018-01-19 03:14:06 +01:00 |
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Gamess_reader.ml
|
Optimized ERIs
|
2018-01-19 03:14:06 +01:00 |
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General_basis.ml
|
Optimized ERIs
|
2018-01-19 03:14:06 +01:00 |
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OneElectronRR.ml
|
Inserted overlap
|
2018-01-22 23:19:24 +01:00 |
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Overlap_primitives.ml
|
Inserted overlap
|
2018-01-22 23:19:24 +01:00 |
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Overlap.ml
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Preparation of Schwartz screening
|
2018-01-23 00:48:45 +01:00 |
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Shell_pair.ml
|
Introducing monocentric
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2018-02-03 16:41:29 +01:00 |
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TwoElectronRR.ml
|
Merge branch 'tuples'
|
2018-02-03 18:39:14 +01:00 |
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TwoElectronRRVectorized.ml
|
Fixed
|
2018-02-03 18:17:17 +01:00 |
