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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-24 12:33:30 +01:00
Commit Graph

10 Commits

Author SHA1 Message Date
eginer
b7787f5e6d trying to speed up the PT2 in TC by transposing the array of tc integrals 2024-05-07 19:43:05 +02:00
eginer
a8de10987f added script_tc_jmu_h2o_gd_exc.sh 2024-03-15 17:10:22 +01:00
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cb8c823a2c added script_tc_bh_h2o_gd_exc.sh in fci_tc_bi 2024-03-15 16:27:02 +01:00
eginer
a56488e3a8 fci_tc_bi_ortho works for multi state ninja
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continuous-integration/drone/push Build is failing
2024-03-12 18:23:09 +01:00
eginer
fdc418d72a fixed print in TC 2024-03-12 17:45:50 +01:00
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fee83210a7 Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable 2024-03-12 17:29:44 +01:00
0ef067337d Introducing cipsi_utils for CIPSI and TC-CIPSI 2024-03-12 16:37:52 +01:00
eginer
6e35f8f8f8 fixed n_states > 1 for TC 2024-03-12 15:30:52 +01:00
eginer
9175fb21c9 modifs in json and diagonalize_ci for fci tc bi 2024-03-12 14:05:38 +01:00
b95c8142a5 Moved many modules in plugins/local for quicker installation 2023-11-07 10:27:34 +01:00