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mirror of https://github.com/pfloos/quack synced 2025-01-10 21:18:23 +01:00
Commit Graph

10 Commits

Author SHA1 Message Date
04c70f18d8 minimal changes in many files 2023-12-03 18:47:30 +01:00
a37cfb496e clean up AOtoMO transform 2023-11-22 17:02:46 +01:00
fc0d471481 cleaning up AOtoMO transformation for RHF and UHF 2023-11-22 16:20:14 +01:00
Pierre-Francois Loos
ff8557b684 modify print in test 2023-11-14 14:31:27 +01:00
594805d429 test in GT 2023-11-13 18:36:09 +01:00
821265a7aa rename AOtoMO and MOtoAO 2023-11-10 17:22:51 +01:00
94cc75309e AO <-> MO modifs 2023-11-08 22:58:55 +01:00
90508131e3 working on GHF 2023-10-26 09:35:48 +02:00
5620965a87 merge self-energy and Z in UGTpp 2023-07-31 09:23:43 +02:00
b5ccfb734a remove Vxc and SigX and rename routines in UGT 2023-07-22 21:40:19 +02:00