|
Basis_lexer.mll
|
Reading both XYZ and Zmatrix
|
2018-01-17 15:56:57 +01:00 |
|
Basis.ml
|
private type
|
2018-02-13 13:55:16 +01:00 |
|
Basis.mli
|
Introduces Simulation
|
2018-02-09 00:37:25 +01:00 |
|
Contracted_shell_type.ml
|
A lot of cleaning
|
2018-02-13 17:36:25 +01:00 |
|
Contracted_shell_type.mli
|
A lot of cleaning
|
2018-02-13 17:36:25 +01:00 |
|
Contracted_shell.ml
|
A lot of cleaning
|
2018-02-13 17:36:25 +01:00 |
|
Contracted_shell.mli
|
private type
|
2018-02-13 13:55:16 +01:00 |
|
ContractedShellPair.ml
|
Accelerated scalar RR
|
2018-02-12 00:02:12 +01:00 |
|
ERI_parallel.ml
|
Clean
|
2018-02-14 18:08:43 +01:00 |
|
ERI.ml
|
Working {x;y;z;tot}
|
2018-02-19 17:32:44 +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 |
|
KinInt.ml
|
Working on HF
|
2018-02-21 17:06:24 +01:00 |
|
NucInt.ml
|
Working on HF
|
2018-02-21 17:06:24 +01:00 |
|
OneElectronRR.ml
|
Working {x;y;z;tot}
|
2018-02-19 17:32:44 +01:00 |
|
Overlap_primitives.ml
|
Fixed Overlap
|
2018-02-06 16:33:28 +01:00 |
|
Overlap.ml
|
Working on HF
|
2018-02-21 17:06:24 +01:00 |
|
ShellPair.ml
|
Optimizations
|
2018-02-10 03:37:00 +01:00 |
|
TwoElectronRR.ml
|
Introduced TRR
|
2018-02-21 20:21:45 +01:00 |
|
TwoElectronRRVectorized.ml
|
Cleaning in ERI
|
2018-02-21 17:27:31 +01:00 |
