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Mono Color

• 092a3f5e6d OK with LR in RPA routines Pierre-Francois Loos 2023-07-18 11:53:38 +0200
• 266be65f2e OK for ppLR Pierre-Francois Loos 2023-07-18 09:59:25 +0200
• b4d96d1065 Merge branch 'master' of github.com:pfloos/QuAcK Pierre-Francois Loos 2023-07-18 09:20:15 +0200
• 65ddd8df20 remove MO.dat Pierre-Francois Loos 2023-07-18 09:20:07 +0200
• 5705e5d29c
  Update README.md Pierre-Francois Loos 2023-07-18 09:07:50 +0200
• 608a62dd6a remove construction of matrices in ppRPA Pierre-Francois Loos 2023-07-17 23:05:49 +0200
• 91954dba8d remove so GT routines Pierre-Francois Loos 2023-07-17 22:31:28 +0200
• 8c0a682aed rename ACFDT routines Pierre-Francois Loos 2023-07-17 15:17:25 +0200
• 1f8dcf8db5 rename ACFDT routines Pierre-Francois Loos 2023-07-17 15:17:02 +0200
• 760e5ebb8d clean up ppACFDT Pierre-Francois Loos 2023-07-17 14:50:16 +0200
• af6a2038d6 fix bug in MP module Pierre-Francois Loos 2023-07-17 14:24:49 +0200
• 95807231fe add MP module Pierre-Francois Loos 2023-07-17 14:21:39 +0200
• a2ab1fa782 remove MP2F12 Pierre-Francois Loos 2023-07-17 14:09:29 +0200
• db1733088a renaming in HF and MP variables Pierre-Francois Loos 2023-07-17 13:51:52 +0200
• f7623c3ed6 remove read/write guess Pierre-Francois Loos 2023-07-17 13:39:35 +0200
• 62b9722256 remove read/write guess Pierre-Francois Loos 2023-07-17 13:39:13 +0200
• 2c7653b7bc add HF module Pierre-Francois Loos 2023-07-17 13:35:24 +0200
• ae540679cd more renaming pfloos 2023-07-12 23:16:37 +0200
• 69faf94a4f renaming again pfloos 2023-07-12 22:56:20 +0200
• 76bc19504d rename LR matrices pfloos 2023-07-12 22:37:04 +0200
• 75415d2427 remove ADC pfloos 2023-07-12 22:12:28 +0200
• d6eb90df47 moving calculations of Z in Sig Pierre-Francois Loos 2023-07-12 14:13:45 +0200
• aec99cb41e Merge branch 'master' of github.com:pfloos/QuAcK Pierre-Francois Loos 2023-07-12 13:34:18 +0200
• d207fb5173 renaming LR routines and fix bug in Z GW Pierre-Francois Loos 2023-07-12 13:34:10 +0200
• aa7de7c115
  Update README.md Pierre-Francois Loos 2023-07-12 13:02:27 +0200
• d697fe9b9d remove INSTALL.md Pierre-Francois Loos 2023-07-10 22:25:19 +0200
• 8b05a4a771
  Update README.md Pierre-Francois Loos 2023-07-10 21:25:47 +0200
• 94497e8a6a
  Update and rename INSTALL.txt to INSTALL.md Pierre-Francois Loos 2023-07-10 21:19:26 +0200
• db9cd754ee
  Update INSTALL.txt Pierre-Francois Loos 2023-07-10 21:18:23 +0200
• e0dcbbdd39
  Update README.md Pierre-Francois Loos 2023-07-10 20:21:37 +0200
• 999bcb6f31
  Update README.md Pierre-Francois Loos 2023-07-10 20:19:34 +0200
• ac25c5fa70
  Update README.md Pierre-Francois Loos 2023-07-10 20:16:59 +0200
• 2dca322b70
  Update README.md Pierre-Francois Loos 2023-07-10 20:14:51 +0200
• 541d873cef
  Update README.md Pierre-Francois Loos 2023-07-10 20:10:16 +0200
• a7a8a13d15
  Update README.md Pierre-Francois Loos 2023-07-10 20:07:04 +0200
• d4ca292ffd
  Update README.md Pierre-Francois Loos 2023-07-10 20:04:45 +0200
• 7732f14852
  Update README.md Pierre-Francois Loos 2023-07-10 20:04:25 +0200
• d76ff8224f
  Update README.md Pierre-Francois Loos 2023-07-10 20:01:49 +0200
• 2060269330
  Update README.md Pierre-Francois Loos 2023-07-10 20:00:15 +0200
• 3e966fb8d0
  Update README.md Pierre-Francois Loos 2023-07-10 19:59:29 +0200
• b32869dea6
  Update README.md Pierre-Francois Loos 2023-07-10 19:58:37 +0200
• 57d6489483
  Update README.md Pierre-Francois Loos 2023-07-10 19:57:20 +0200
• 2e11983b40
  Update README.md Pierre-Francois Loos 2023-07-10 19:56:57 +0200
• 6e93f1f6bb add dynamic BSE2@GW EnzoMonino 2023-07-10 14:50:16 +0200
• 6d4199f989 add optimization in GF EnzoMonino 2023-07-10 13:53:39 +0200
• 06df6109fa add optimization in GT EnzoMonino 2023-07-10 11:53:42 +0200
• d93fbcb591 add optimization in BSE@GW EnzoMonino 2023-07-10 11:36:45 +0200
• b851d09c48 GF2 BSE2 rename Pierre-Francois Loos 2023-07-04 12:07:38 +0200
• d704b367bc rename more files Pierre-Francois Loos 2023-07-04 11:56:00 +0200
• 86ae96511b rename GW routines Pierre-Francois Loos 2023-07-04 10:51:03 +0200
• f90a679f0c rename GW routines Pierre-Francois Loos 2023-07-04 10:44:20 +0200
• 490dd13c0d remove SOSEX Pierre-Francois Loos 2023-07-04 10:37:54 +0200
• 812721e5d9 rename GTpp routines Pierre-Francois Loos 2023-07-04 10:32:47 +0200
• 2fc348ebe4 qsGTeh Pierre-Francois Loos 2023-07-04 09:27:35 +0200
• b701886e5c fix 2 bugs en GTeh Pierre-Francois Loos 2023-07-04 08:29:16 +0200
• 1110cd6319 evGTeh Pierre-Francois Loos 2023-07-03 23:15:07 +0200
• 4f3b3102d3 remove numgrid Pierre-Francois Loos 2023-07-03 22:33:50 +0200
• 5aff287039 remove eDFT Pierre-Francois Loos 2023-07-03 14:41:46 +0200
• 989e0b9bd8 remove qcaml for pyscf Pierre-Francois Loos 2023-07-03 14:33:48 +0200
• af5d4f4226 fixing antoine pfloos 2023-07-02 16:21:14 +0200
• 4334ce3ee6 missing files Antoine Marie 2023-06-30 19:17:35 +0200
• 86e9ee3dd6 change compiler to gfortran and read basis to be compatible with GoDuck.sh Antoine Marie 2023-06-30 16:56:07 +0200
• 545b5fb5e2 trying to fix diverging version Antoine Marie 2023-06-30 16:47:26 +0200
• a8a8218798 ok with ehGT pfloos 2023-06-29 20:46:47 +0200
• 3bab883de1 missing file Pierre-Francois Loos 2023-06-29 18:56:01 +0200
• f5d6971e1f experimental files Pierre-Francois Loos 2023-06-29 18:54:00 +0200
• 552005f910 dgemm instead of matmul for nVV matrix multiplication in sort_ppRPA.f90 Antoine Marie 2023-06-14 16:53:16 +0200
• 3941db73e3 fix conflict, nuclear energy fixed in previous commit Antoine Marie 2023-04-20 17:03:23 +0200
• c74579254d save file before pull Antoine Marie 2023-04-20 17:00:34 +0200
• fe8768470d remove in QuAcK Pierre-Francois Loos 2023-04-12 22:30:28 +0200
• 0746f2110a corrected Pierre-Francois Loos 2023-04-12 22:30:06 +0200
• f998fb3a13 remove self-screening correction Pierre-Francois Loos 2023-04-12 22:29:10 +0200
• 6515773839 bug in ufGW and ufG0W0 Pierre-Francois Loos 2023-04-12 21:41:30 +0200
• 78cefb5759 fix conflicts trexio Antoine Marie 2023-03-14 14:15:00 +0100
• 1b0eaf2fba add SRG in input Antoine Marie 2023-03-14 14:13:33 +0100
• 535b6e2aa2 modif in utils Antoine Marie 2023-03-14 14:12:43 +0100
• 7598446ed8 openMP for GW bis Antoine Marie 2023-03-14 14:12:19 +0100
• 3a80069009 openMP for GW Antoine Marie 2023-03-14 14:11:54 +0100
• 01b0a4d823 add SRG files Antoine Marie 2023-03-14 14:11:01 +0100
• 616d6747e6 matrix multiplication for the AOtoMO transformation Antoine Marie 2023-03-14 14:09:07 +0100
• c797967170 optimize memory in diagonalizations Pierre-Francois Loos 2023-03-13 10:14:26 +0100
• a1b4abf10a fix bug in BSE2@GW Pierre-Francois Loos 2023-03-13 10:10:40 +0100
• 239aef1120 Merge branch 'master' of github.com:pfloos/QuAcK Antoine MARIE 2023-01-23 10:34:07 +0100
• 0e32c9c65c missing parameter in MP2 call was preventing qsGF2 from running Antoine MARIE 2023-01-23 10:12:44 +0100
• ab6a8c7357 fix reg in MP2 Pierre-Francois Loos 2023-01-12 10:20:12 +0100
• e41097e8c2 reversing loops in HF Pierre-Francois Loos 2022-12-10 09:03:28 +0100
• b450829846 Merge branch 'master' of github.com:pfloos/QuAcK Antoine MARIE 2022-12-08 15:07:03 +0100
• 8c1dcd96e1 change ordering of some loop to increase speed of qsGW Antoine MARIE 2022-12-08 15:06:18 +0100
• c130e3a352 fix bug in CCGW Pierre-Francois Loos 2022-12-06 09:15:32 +0100
• ab2857b377 warning for FCI NYI Pierre-Francois Loos 2022-12-01 09:45:30 +0100
• bdbd201d6c remove MP2F12 Pierre-Francois Loos 2022-12-01 09:42:23 +0100
• 196e4c917a introduce SRG regularizer in GF, GW, and GT and add option for reg MP2 Pierre-Francois Loos 2022-11-30 17:18:51 +0100
• 597c4a9885 getting rid of G0W and GW0 Pierre-Francois Loos 2022-11-30 16:41:43 +0100
• 61b9b9472c getting rid of G0W and GW0 Pierre-Francois Loos 2022-11-30 16:41:19 +0100
• 733e2794ec BeO Pierre-Francois Loos 2022-11-29 16:01:02 +0100
• f549c62d5c 2T geometry Pierre-Francois Loos 2022-11-29 14:50:23 +0100
• 0b56f97398 update DIIS in HF and qsGW Pierre-Francois Loos 2022-11-29 14:47:51 +0100
• 76a3b9cfff SRG qsGW Pierre-Francois Loos 2022-11-29 12:11:09 +0100
• 2a46cc4617 remove old methods and options Pierre-Francois Loos 2022-11-29 09:54:18 +0100
• 16fe319ef3 remove obselete routines Pierre-Francois Loos 2022-11-29 09:35:50 +0100