Abdallah Ammar
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933780a847
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Merge branch 'master' into work_env
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2024-11-05 07:57:26 +01:00 |
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Abdallah Ammar
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9986ff09dd
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q -> p in RGW_self_energy
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2024-11-05 07:56:10 +01:00 |
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Abdallah Ammar
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c2031c9d8a
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Merge branch 'master' into work_env
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2024-11-05 07:51:35 +01:00 |
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Abdallah Ammar
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52a1346bdb
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q -> p in GGW_self_energy
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2024-11-05 07:48:49 +01:00 |
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Abdallah Ammar
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344c2bd4fa
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add ifort again
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2024-11-05 07:45:50 +01:00 |
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Abdallah Ammar
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664a98e57f
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merge with master
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2024-11-04 22:32:23 +01:00 |
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Abdallah Ammar
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e4f89c21f5
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Merge branch 'master' into work_env
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2024-11-04 22:14:26 +01:00 |
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d1f9daa3e5
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remove warning in ufG0T0pp
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2024-11-04 19:35:42 +01:00 |
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4692017d56
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remove warnings
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2024-11-04 19:30:06 +01:00 |
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Abdallah Ammar
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336c67ac3c
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rm more warnings in Davidson
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2024-11-04 19:09:00 +01:00 |
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Antoine Marie
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9090133281
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Merge branch 'master' of github.com:pfloos/QuAcK
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2024-11-04 17:01:09 +01:00 |
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Antoine Marie
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0554bdd53f
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full ppBSE@GT and full dynBSE@GW in spin orbital and spatial orb
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2024-11-04 17:00:51 +01:00 |
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Abdallah Ammar
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fcb9c16313
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dav warnings
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2024-11-04 15:15:49 +01:00 |
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Abdallah Ammar
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bb0d68eef0
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fixed conflic bef merging
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2024-11-04 11:31:36 +01:00 |
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Abdallah Ammar
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b0eb4cb55e
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saving work on Dav on Olympe
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2024-11-04 11:29:41 +01:00 |
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Abdallah Ammar
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df8eedf64e
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handle the compilation options
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2024-11-01 12:27:51 +01:00 |
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Abdallah Ammar
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3552975cee
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ensure QUACK_ROOT is defined
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2024-11-01 10:59:35 +01:00 |
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33a2debb3a
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Merge branch 'master' of github.com:pfloos/QuAcK
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2024-10-31 19:36:15 +01:00 |
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2500a98feb
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one micro modif in RGW_phBSE
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2024-10-31 19:36:08 +01:00 |
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Antoine Marie
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6ed7fd09be
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saving work in T matrix kernel
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2024-10-31 17:17:50 +01:00 |
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Antoine Marie
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21e5b55641
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Merge branch 'master' of github.com:pfloos/QuAcK
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2024-10-31 16:07:52 +01:00 |
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Antoine Marie
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5b5d3376c9
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T matrix kernel of the ppBSE working in TDA in RHF and GHF
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2024-10-31 16:07:25 +01:00 |
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Abdallah Ammar
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52894ba30e
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absolute PATH in Fortran I/O
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2024-10-31 15:42:22 +01:00 |
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Pierre-Francois Loos
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6667fb79c1
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debuging UACFDT
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2024-10-31 12:15:01 +01:00 |
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Abdallah Ammar
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a6bc29e958
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avoid rm error message if file does not exist
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2024-10-31 11:16:55 +01:00 |
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Abdallah Ammar
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e0cee99d02
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absolute path for mkdir
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2024-10-31 11:12:18 +01:00 |
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Abdallah Ammar
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1f56026c29
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separete binary code and I/O when --working_dir is used
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2024-10-31 10:46:00 +01:00 |
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127aeabf72
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more cleaning
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2024-10-30 10:44:39 +01:00 |
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1a4ad3e225
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cleaning
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2024-10-30 10:08:39 +01:00 |
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Antoine Marie
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df7f38b7b5
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ppBSE GT
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2024-10-30 09:41:25 +01:00 |
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Antoine Marie
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1ca40c25c4
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Merge branch 'master' of github.com:pfloos/QuAcK
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2024-10-30 09:37:06 +01:00 |
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Antoine Marie
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6c37311e38
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ppBSE GT
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2024-10-30 09:36:36 +01:00 |
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9b32dbd749
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fix stupid bug in UGW static kernel
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2024-10-30 09:28:39 +01:00 |
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Abdallah Ammar
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f2ead7138b
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read mol geom from working dir
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2024-10-29 23:43:33 +01:00 |
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Antoine Marie
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61288e474d
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ppBSE dynamic correction for the block D is working
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2024-10-25 14:44:35 +02:00 |
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Antoine Marie
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7c972806a0
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Merge branch 'master' of github.com:pfloos/QuAcK
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2024-10-23 18:07:04 +02:00 |
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ba01dd71fa
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looking for a bug in UGW_phBSE
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2024-10-15 02:14:51 +08:00 |
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2472e632f8
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fixing UGW_phBSE and UGW_phACFDT
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2024-10-14 04:11:48 +02:00 |
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96100f5cfd
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remove ccGW for now
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2024-10-11 15:34:35 +02:00 |
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Antoine Marie
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eca55bbcd8
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save modified file to pull
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2024-10-10 09:53:32 +02:00 |
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Pierre-Francois Loos
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da6dada877
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clean GTpp in progress but unfinished
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2024-10-01 16:14:33 +02:00 |
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Pierre-Francois Loos
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75479f07f2
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proper spin adaptation in GTpp
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2024-10-01 14:42:37 +02:00 |
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19be97355d
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saving
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2024-10-01 09:42:25 +02:00 |
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172ca40f37
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saving worj in ccGW
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2024-09-30 23:06:00 +02:00 |
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Pierre-Francois Loos
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80f393ded2
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typo flow RG0W0
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2024-09-27 15:31:38 +02:00 |
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ccd4ad570b
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saving work in ppBSE@GW
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2024-09-26 23:04:45 +02:00 |
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Pierre-Francois Loos
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b103364b76
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mess
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2024-09-26 20:06:23 +02:00 |
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Pierre-Francois Loos
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3494a6605a
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missing file
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2024-09-26 19:54:04 +02:00 |
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Pierre-Francois Loos
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26fde9363c
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debugging uf ppBSE
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2024-09-26 17:55:06 +02:00 |
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Pierre-Francois Loos
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88b0424cd3
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GGW ppBSE dyn
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2024-09-26 14:26:52 +02:00 |
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