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mirror of https://gitlab.com/scemama/QCaml.git synced 2024-12-22 20:33:36 +01:00
QCaml/mo/lib
2021-02-03 10:47:34 +01:00
..
basis.ml Added exponential of matrix 2020-12-17 12:55:11 +01:00
basis.mli Added Hartree_Fock 2020-10-18 01:58:22 +02:00
class.ml MP2 OK 2021-01-01 16:39:33 +01:00
class.mli MP2 OK 2021-01-01 16:39:33 +01:00
dune Cleaned readme for auto-generation 2020-12-28 12:23:39 +01:00
fock.ml Added Hartree_Fock 2020-10-18 01:58:22 +02:00
fock.mli Added Hartree_Fock 2020-10-18 01:58:22 +02:00
frozen_core.ml MP2 OK 2021-01-01 16:39:33 +01:00
frozen_core.mli MP2 OK 2021-01-01 16:39:33 +01:00
guess.ml Better tests 2020-12-07 14:12:35 +01:00
guess.mli Added Hartree_Fock 2020-10-18 01:58:22 +02:00
hartree_fock.ml Localization 2021-01-30 19:07:59 +01:00
hartree_fock.mli Added Hartree_Fock 2020-10-18 01:58:22 +02:00
localization.ml Moving all MOs is not optimal 2021-02-03 10:47:34 +01:00
localization.mli Pretty printer for localization 2021-02-03 09:31:11 +01:00
mo_dim.ml Added Hartree_Fock 2020-10-18 01:58:22 +02:00
mo_dim.mli Added Hartree_Fock 2020-10-18 01:58:22 +02:00