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mirror of https://gitlab.com/scemama/QCaml.git synced 2024-12-22 20:33:36 +01:00
QCaml/test
2020-10-26 11:52:24 +01:00
..
caffeine.xyz Added AO basis tests 2020-10-03 00:54:17 +02:00
cc-pvdz Added AO basis tests 2020-10-03 00:54:17 +02:00
cc-pvdz-f12-ri Initial new repo 2020-09-26 12:02:53 +02:00
cc-pvqz to_bigarray_inplace 2020-10-03 15:27:48 +02:00
cc-pvtz to_bigarray_inplace 2020-10-03 15:27:48 +02:00
dune Added Hartree_Fock 2020-10-18 01:58:22 +02:00
lih_eri_lr.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
lih_eri.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
lih_kin.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
lih_nuc.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
lih_overlap.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
lih.xyz to_bigarray_inplace 2020-10-03 15:27:48 +02:00
run_tests.ml Added a test for Hartree-Fock 2020-10-26 11:52:24 +01:00
water_eri_lr.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
water_eri.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
water_kin.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
water_nuc.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
water_overlap.ref to_bigarray_inplace 2020-10-03 15:27:48 +02:00
water.xyz Added AO basis tests 2020-10-03 00:54:17 +02:00