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mirror of https://github.com/pfloos/quack synced 2024-10-20 06:48:15 +02:00
QuAcK/src
2024-09-02 22:18:53 +02:00
..
AOtoMO RHF in nOrb representation has been tested 2024-09-01 13:50:29 +02:00
CC passing Fock matrix and others in R branch 2024-09-02 22:18:53 +02:00
CI RHF in nOrb representation has been tested 2024-09-01 13:50:29 +02:00
GF udapted qsRGF2, qsRGTeh, qsRGTpp and qsRGW pour nOrb 2024-09-01 15:29:33 +02:00
GT udapted qsRGF2, qsRGTeh, qsRGTpp and qsRGW pour nOrb 2024-09-01 15:29:33 +02:00
GW udapted qsRGF2, qsRGTeh, qsRGTpp and qsRGW pour nOrb 2024-09-01 15:29:33 +02:00
HF passing Fock matrix and others in R branch 2024-09-02 22:18:53 +02:00
LR v0 of FeatherBench 2024-08-30 20:15:39 +02:00
MP fixed bug in RMP call 2024-09-01 15:07:01 +02:00
QuAcK passing Fock matrix and others in R branch 2024-09-02 22:18:53 +02:00
RPA introduce nBas_MOs in RGF 2024-08-28 21:11:05 +02:00
test few modifs in QuAck tests 2024-08-29 15:19:16 +02:00
utils clean up format 2024-09-01 21:42:10 +02:00
.gitignore int directory 2020-10-13 20:59:03 +02:00
eDFT.tgz remove eDFT 2023-07-03 14:41:46 +02:00
make_ninja.py added non-sym diag with biorthog condition 2024-08-30 19:10:54 +02:00
Makefile Linux 2020-10-14 17:09:07 +02:00