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mirror of https://github.com/pfloos/quack synced 2024-11-19 20:42:44 +01:00
quack/src/GW
2023-07-28 14:14:35 +02:00
..
dUSigmaC.f90 regularized GW 2021-12-17 11:41:40 +01:00
evGW.f90 updating Z in QP roots 2023-07-27 21:23:40 +02:00
evUGW.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
G0W0.f90 rename LR routines 2023-07-28 14:14:35 +02:00
GW_dSigC.f90 fix root search 2023-07-27 17:43:18 +02:00
GW_excitation_density.f90 include B term in phBSE2@GW 2023-07-21 11:18:00 +02:00
GW_phACFDT.f90 fix bug 2023-07-20 16:03:09 +02:00
GW_phBSE2_dynamic_kernel_A.f90 include B term in phBSE2@GW 2023-07-21 11:18:00 +02:00
GW_phBSE2_dynamic_kernel_B.f90 include B term in phBSE2@GW 2023-07-21 11:18:00 +02:00
GW_phBSE2_static_kernel_A.f90 clean up LR in GW mess 2023-07-19 11:03:55 +02:00
GW_phBSE2_static_kernel_B.f90 clean up LR in GW mess 2023-07-19 11:03:55 +02:00
GW_phBSE_dynamic_kernel_A.f90 include B term in phBSE2@GW 2023-07-21 11:18:00 +02:00
GW_phBSE_dynamic_kernel_B.f90 fix bug in non-TDA dBSE@GW 2023-07-21 11:28:12 +02:00
GW_phBSE_dynamic_perturbation.f90 fix bug in non-TDA dBSE@GW 2023-07-21 11:28:12 +02:00
GW_phBSE_static_kernel_A.f90 include B term in phBSE2@GW 2023-07-21 11:18:00 +02:00
GW_phBSE_static_kernel_B.f90 clean up LR in GW mess 2023-07-19 11:03:55 +02:00
GW_phBSE.f90 rename LR routines 2023-07-28 14:14:35 +02:00
GW_ppBSE_dynamic_kernel_B.f90 ppBSE dynamic kernel B and D 2023-07-24 21:45:51 +02:00
GW_ppBSE_dynamic_kernel_C.f90 fix bug in ppBSE@GW 2023-07-24 22:40:00 +02:00
GW_ppBSE_dynamic_kernel_D.f90 ppBSE dynamic kernel B and D 2023-07-24 21:46:03 +02:00
GW_ppBSE_dynamic_perturbation.f90 ppBSE2@GF2 2023-07-25 10:46:56 +02:00
GW_ppBSE_static_kernel_B.f90 ppBSE kernel 2023-07-24 15:01:54 +02:00
GW_ppBSE_static_kernel_C.f90 fix memory leaks in ppBSE 2023-07-27 10:11:35 +02:00
GW_ppBSE_static_kernel_D.f90 fix memory leaks in ppBSE 2023-07-27 10:11:35 +02:00
GW_ppBSE.f90 rename LR routines 2023-07-28 14:14:35 +02:00
GW_QP_graph.f90 updating Z in QP roots 2023-07-27 21:23:40 +02:00
GW_self_energy_diag.f90 fix bug in HF diis 2023-07-23 22:03:42 +02:00
GW_self_energy.f90 fix bug in HF diis 2023-07-23 22:03:42 +02:00
GW_SigC.f90 fix root search 2023-07-27 17:43:18 +02:00
GW.f90 remove ERI_AO in GW GT 2023-07-23 23:10:57 +02:00
print_evGW.f90 regularized GW 2021-12-17 11:41:40 +01:00
print_evUGW.f90 regularized GW 2021-12-17 11:41:40 +01:00
print_G0W0.f90 regularized GW 2021-12-17 11:41:40 +01:00
print_qsGW.f90 regularized GW 2021-12-17 11:41:40 +01:00
print_qsUGW.f90 problem with rcond in DIIS fixed 2022-01-06 22:36:30 +01:00
print_UG0W0.f90 regularized GW 2021-12-17 11:41:40 +01:00
qsGW.f90 rename LR routines 2023-07-28 14:14:35 +02:00
qsUGW.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
regularized_renormalization_factor.f90 remove COHSEX and modify phLR in GW routines 2023-07-18 14:59:18 +02:00
regularized_self_energy_correlation_diag.f90 remove COHSEX and modify phLR in GW routines 2023-07-18 14:59:18 +02:00
regularized_self_energy_correlation.f90 remove COHSEX and modify phLR in GW routines 2023-07-18 14:59:18 +02:00
renormalization_factor_SRG.f90 trying to fix diverging version 2023-06-30 16:47:26 +02:00
self_energy_correlation_SRG.f90 add SRG files 2023-03-14 14:11:01 +01:00
self_energy_exchange_diag.f90 spinorbital BSE@G0T0 2022-01-26 13:05:16 +01:00
self_energy_exchange.f90 regularized GW 2021-12-17 11:41:40 +01:00
SRG_qsGW.f90 rename LR routines 2023-07-28 14:14:35 +02:00
static_screening_W.f90 missing files for BSE2@GW 2022-11-28 15:21:05 +01:00
ufBSE.f90 experimental files 2023-06-29 18:54:00 +02:00
ufG0W0.f90 renaming LR routines and fix bug in Z GW 2023-07-12 13:34:10 +02:00
ufGW.f90 bug in ufGW and ufG0W0 2023-04-12 21:41:30 +02:00
UG0W0.f90 rename LR routines 2023-07-28 14:14:35 +02:00
UGW_excitation_density.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
UGW_phACFDT.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
UGW_phBSE_dynamic_kernel_A.f90 more UGW renaming 2023-07-27 22:07:02 +02:00
UGW_phBSE_dynamic_perturbation.f90 more UGW renaming 2023-07-27 22:07:02 +02:00
UGW_phBSE_static_kernel_A.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
UGW_phBSE_static_kernel_B.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
UGW_phBSE.f90 rename LR routines 2023-07-28 14:14:35 +02:00
UGW_QP_graph.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
UGW_self_energy_diag.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
UGW_self_energy.f90 rename UGW routines 2023-07-27 21:59:18 +02:00
unrestricted_regularized_renormalization_factor.f90 regularized GW 2021-12-17 11:41:40 +01:00
unrestricted_regularized_self_energy_correlation_diag.f90 regularized GW 2021-12-17 11:41:40 +01:00
unrestricted_regularized_self_energy_correlation.f90 fix bug in regularized self energy 2022-01-06 22:13:45 +01:00
USigmaC.f90 regularized GW 2021-12-17 11:41:40 +01:00