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mirror of https://gitlab.com/scemama/QCaml.git synced 2024-11-15 10:33:39 +01:00
QCaml/Basis
2018-01-23 19:26:28 +01:00
..
Basis_lexer.mll Reading both XYZ and Zmatrix 2018-01-17 15:56:57 +01:00
Basis.ml Inserted overlap 2018-01-22 23:19:24 +01:00
Basis.mli Inserted overlap 2018-01-22 23:19:24 +01:00
Contracted_shell.ml Optimized Zkey 2018-01-20 12:10:32 +01:00
ERI.ml Schwartz 2018-01-23 19:26:28 +01:00
Gamess_parser.mly Optimized ERIs 2018-01-19 03:14:06 +01:00
Gamess_reader.ml Optimized ERIs 2018-01-19 03:14:06 +01:00
General_basis.ml Optimized ERIs 2018-01-19 03:14:06 +01:00
OneElectronRR.ml Inserted overlap 2018-01-22 23:19:24 +01:00
Overlap_primitives.ml Inserted overlap 2018-01-22 23:19:24 +01:00
Overlap.ml Preparation of Schwartz screening 2018-01-23 00:48:45 +01:00
Shell_pair.ml Schwartz 2018-01-23 19:26:28 +01:00
TwoElectronRR.ml Schwartz 2018-01-23 19:26:28 +01:00