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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-23 03:53:29 +01:00
qp2/plugins/local
2024-08-08 11:39:42 +02:00
..
ao_many_one_e_ints fixed bug for env_type = None 2024-01-17 19:23:24 +01:00
ao_tc_eff_map hamiltonian -> jastrow 2024-01-15 19:02:05 +01:00
basis_correction added sparse cholesky mu_of_r 2024-05-23 14:45:33 +02:00
bi_ort_ints Combine calculation of Left & RIGHT MOs in r 2024-08-08 11:39:42 +02:00
bi_ortho_mos Combine calculation of Left & RIGHT MOs in r 2024-08-08 11:39:42 +02:00
casscf_tc_bi Moved many modules in plugins/local for quicker installation 2023-11-07 10:27:34 +01:00
cipsi_tc_bi_ortho fixed some weird dependencies in TC, introduced an AO cholesky 2e function 2024-07-16 17:44:48 +02:00
fci_tc_bi fixed some weird dependencies in TC, introduced an AO cholesky 2e function 2024-07-16 17:44:48 +02:00
gpu_intel Fix link stage for intel gpus 2024-07-09 23:04:22 +02:00
gpu_nvidia Finished r1 2024-07-03 18:24:13 +02:00
gpu_x86 Finished r1 2024-07-03 18:24:13 +02:00
jastrow devide BH jast coeff by 2 direct 2024-08-04 11:58:19 +02:00
mo_localization Begining to make some cleaning in TC 2024-04-25 19:48:17 +02:00
non_h_ints_mu devide BH jast coeff by 2 direct 2024-08-04 11:58:19 +02:00
non_hermit_dav TC-SCF CLEANED 2024-05-01 23:10:18 +02:00
normal_order_old fixed forgotten stuffs in normal_order_old/NEED 2024-05-21 12:26:30 +02:00
old_delta_tc_qmc compiling after some cleaning 2024-05-06 18:58:12 +02:00
ortho_three_e_ints TC SPRING CLEANING: BEGINNING 2024-05-01 20:25:01 +02:00
qmckl Fixing compilation 2023-11-07 11:12:10 +01:00
slater_tc fixed some weird dependencies in TC, introduced an AO cholesky 2e function 2024-07-16 17:44:48 +02:00
slater_tc_no_opt compiling after some cleaning 2024-05-06 18:58:12 +02:00
spher_harm beginning to put cholesky in CASSCF 2024-07-11 13:57:28 +02:00
tc_bi_ortho Combine calculation of Left & RIGHT MOs in r 2024-08-08 11:39:42 +02:00
tc_int devide BH jast coeff by 2 direct 2024-08-04 11:58:19 +02:00
tc_keywords removed stupid print in tc_keywords/EZFIO.cfg 2024-05-23 10:02:46 +02:00
tc_progs minor modifs 2024-05-21 13:01:48 +02:00
tc_scf devide BH jast coeff by 2 direct 2024-08-04 11:58:19 +02:00
tuto_plugins fixed a bug in cholesk_ao_transp 2024-05-15 15:41:35 +02:00
.gitignore Develop (#15) 2019-03-07 16:29:06 +01:00