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mirror of https://github.com/pfloos/quack synced 2024-12-22 20:35:36 +01:00
quack/src
2023-04-12 22:30:06 +02:00
..
ADC bug in makefile debug 2020-10-14 16:02:09 +02:00
AOtoMO matrix multiplication for the AOtoMO transformation 2023-03-14 14:09:07 +01:00
CC reversing loops in HF 2022-12-10 09:03:28 +01:00
CI clean BSE2 2022-02-01 11:42:31 +01:00
eDFT add CC-B88 2022-02-07 10:47:15 +01:00
GF fix reg in MP2 2023-01-12 10:20:12 +01:00
GT introduce SRG regularizer in GF, GW, and GT and add option for reg MP2 2022-11-30 17:18:51 +01:00
GW corrected 2023-04-12 22:30:06 +02:00
HF reversing loops in HF 2022-12-10 09:03:28 +01:00
LR openMP for GW 2023-03-14 14:11:54 +01:00
MP introduce SRG regularizer in GF, GW, and GT and add option for reg MP2 2022-11-30 17:18:51 +01:00
numgrid ninja 2020-10-13 13:44:24 +02:00
QuAcK remove self-screening correction 2023-04-12 22:29:10 +02:00
RPA update eDFT module 2022-11-28 10:52:06 +01:00
utils fix conflicts 2023-03-14 14:15:00 +01:00
.gitignore int directory 2020-10-13 20:59:03 +02:00
make_ninja.py fix bug in individual energies for VWN 2021-11-01 21:51:02 +01:00
Makefile Linux 2020-10-14 17:09:07 +02:00