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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-25 21:03:32 +01:00
Commit Graph

13 Commits

Author SHA1 Message Date
eginer
d9cd6e2b37 Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable 2024-09-05 22:02:20 +02:00
eginer
65bef0b266 new attempt of mu(r) 2024-08-27 15:24:46 +02:00
Abdallah Ammar
dee440747f devide BH jast coeff by 2 direct 2024-08-04 11:58:19 +02:00
AbdAmmar
1a36d974b0 saving lcpq-ampere 2024-04-07 00:43:44 +02:00
AbdAmmar
8534b5c104 fixed bug for env_type = None 2024-01-17 19:23:24 +01:00
Abdallah Ammar
35a773ef7e j1e + j2e added properly 2024-01-17 11:10:28 +01:00
AbdAmmar
bab59335f3 debuging 1e-Jastrow 2024-01-17 06:11:06 +01:00
AbdAmmar
430606a617 added fit 1e-Jastrow on AOs 2024-01-16 23:10:44 +01:00
AbdAmmar
7bcc963a32 homogenisation avec qmch=chem 2024-01-16 19:07:20 +01:00
AbdAmmar
da7edff3b7 added README for Jastrow 2024-01-16 00:02:25 +01:00
AbdAmmar
c3c65927ca added charge-harmonizer one-body Jastrow 2024-01-15 23:35:26 +01:00
AbdAmmar
fbcd70db2c hamiltonian -> jastrow 2024-01-15 19:02:05 +01:00
AbdAmmar
ef60141fbf new keywords for Jastrow 2024-01-15 12:02:38 +01:00