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qp_plugins_scemama/devel/svdwf
History
Abdallah Ammar 7b442c5341 svdwf with tc
2021-11-02 16:18:07 +01:00
..
CO_work/decomp/PILC_decomp svdwf with tc 2021-11-02 16:18:07 +01:00
cr2_work svdwf with tc 2021-11-02 16:18:07 +01:00
f2_work svdwf with tc 2021-11-02 16:18:07 +01:00
h2o_work/FN_test/cc_pCVDZ svdwf with tc 2021-11-02 16:18:07 +01:00
.gitignore Added svdwf module 2020-09-30 20:44:53 +02:00
ab_products.irp.f Added abproducts 2021-06-08 15:40:54 +02:00
buildpsi_diagSVDit_Anthony_v0.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit_Anthony_v1.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit_Anthony_v2.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit_Anthony_v4.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit_modif_v2.irp.f Added abproducts 2021-06-08 15:40:54 +02:00
buildpsi_diagSVDit_v0.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit_v1.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit_v2.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_diagSVDit.py svd save 2021-07-28 17:19:18 +02:00
buildpsi_eff.irp.f svd save 2021-07-28 17:19:18 +02:00
buildpsi_SVDit.irp.f svd save 2021-07-28 17:19:18 +02:00
checkSVD_EZ.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_2bTSVD_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_3bSVD_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_3bSVD_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_4bTSVD_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_diagSVD_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_FSVD_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_FSVD_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_FSVD_v2.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_svd_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
delta_svd_v2.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
Evar_TruncSVD.irp.f svd save 2021-07-28 17:19:18 +02:00
FSVD_trunc.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
invFSVD_det.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
invFSVD_spindet.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
kl_H_kl_v0.irp.f svd save 2021-07-28 17:19:18 +02:00
kl_H_kl_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
kl_H_kl_v2.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
linear_algebra.irp.f svd save 2021-07-28 17:19:18 +02:00
NEED random svd 2021-04-08 16:31:31 +02:00
perform_RSVD.py svd save 2021-07-28 17:19:18 +02:00
print_2e_integrals.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
print_ij_H_kl_det_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
print_ij_H_kl_det_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
print_ij_H_kl_det.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
print_ij_H_kl_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
print_ij_H_kl_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
printSQ_ab_T_gd_v0.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
printSQ_ij_T_kl.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
psiSVD_naiv1by1_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
psiSVD_naivBbyB_v0.irp.f svd save 2021-07-28 17:19:18 +02:00
psiSVD_naivBbyB_v1.irp.f svd save 2021-07-28 17:19:18 +02:00
psiSVD_naivBbyB_v2.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
psiSVD_pt2_v0.irp.f svd save 2021-07-28 17:19:18 +02:00
psiSVD_pt2_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
pyth_RSVD.py random svd 2021-04-08 16:31:31 +02:00
qmcchemRun.slurm post QMC py 2021-07-31 14:07:03 +02:00
qpRun.slurm post QMC py 2021-07-31 14:07:03 +02:00
QR.py random svd 2021-04-08 16:31:31 +02:00
R3SVD_AMMAR.py random svd 2021-04-08 16:31:31 +02:00
R3SVD_LiYu.py random svd 2021-04-08 16:31:31 +02:00
random_svd.irp.f Merge branch 'master' of gitlab.com:scemama/qp_plugins_scemama 2021-02-22 16:25:16 +01:00
README.rst Added svdwf module 2020-09-30 20:44:53 +02:00
RSVD_ijHkl_det.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
RSVD.irp.f saved 3 fichiers 2021-04-08 16:42:42 +02:00
RSVD.py random svd 2021-04-08 16:31:31 +02:00
run_py.slurm post QMC py 2021-07-31 14:07:03 +02:00
saveSVD_asEZ.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
set_QP_svd.py svd save 2021-07-28 17:19:18 +02:00
SQ_klHkl_v1.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
SVD_rank.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00
SVD.slurm post QMC py 2021-07-31 14:07:03 +02:00
svdwf.irp.f Add dmc_dress 2021-07-28 17:24:03 +02:00
TSVD_err.irp.f svdwf with tc 2021-11-02 16:18:07 +01:00

README.rst 

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svdwf
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