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mirror of https://gitlab.com/scemama/QCaml.git synced 2024-06-19 03:35:28 +02:00
QCaml/Basis
2018-01-19 17:45:55 +01:00
..
Basis_lexer.mll Reading both XYZ and Zmatrix 2018-01-17 15:56:57 +01:00
Basis.ml ERI tested with QP -> OK 2018-01-19 17:45:55 +01:00
Basis.mli Optimized ERIs 2018-01-19 03:14:06 +01:00
Contracted_shell.ml ERI tested with QP -> OK 2018-01-19 17:45:55 +01:00
ERI.ml ERI tested with QP -> OK 2018-01-19 17:45:55 +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
Shell_pair.ml Working on input 2018-01-18 00:21:05 +01:00
TwoElectronRR.ml Optimized ERIs 2018-01-19 03:14:06 +01:00