| fb0102c | Janus Eriksen | 28 September 2019, 22:29:53 UTC | Merge branch 'shared_mem' of gitlab.com:januseriksen/pymbe into shared_mem | 28 September 2019, 22:29:53 UTC |
| 16fc489 | Janus Eriksen | 28 September 2019, 22:29:16 UTC | fix restart bug | 28 September 2019, 22:29:16 UTC |
| e63fcfc | Janus Juul Eriksen | 27 September 2019, 13:20:17 UTC | logo | 27 September 2019, 13:20:17 UTC |
| 1dd3af3 | Janus Juul Eriksen | 27 September 2019, 13:13:53 UTC | made logo smaller | 27 September 2019, 13:13:53 UTC |
| 8e6493e | Janus Juul Eriksen | 27 September 2019, 13:11:26 UTC | work on README.md | 27 September 2019, 13:11:26 UTC |
| 44cb2ed | Janus Juul Eriksen | 27 September 2019, 13:10:17 UTC | added logo | 27 September 2019, 13:10:17 UTC |
| 52c7603 | Janus Juul Eriksen | 27 September 2019, 12:26:36 UTC | typing and doctest in tools.py | 27 September 2019, 12:26:36 UTC |
| 6b9ce4e | Janus Juul Eriksen | 27 September 2019, 08:46:59 UTC | update .gitignore | 27 September 2019, 08:46:59 UTC |
| dff55eb | Janus Juul Eriksen | 26 September 2019, 08:49:32 UTC | small fix | 26 September 2019, 08:49:32 UTC |
| 42d3aff | Janus Juul Eriksen | 24 September 2019, 10:04:34 UTC | pi_pruning fix | 24 September 2019, 10:04:34 UTC |
| 2f61d89 | Janus Juul Eriksen | 23 September 2019, 08:51:23 UTC | restart fix | 23 September 2019, 08:51:23 UTC |
| 503482a | Janus Juul Eriksen | 20 September 2019, 23:55:27 UTC | more restart fixes | 20 September 2019, 23:55:27 UTC |
| 4ebfa58 | Janus Juul Eriksen | 20 September 2019, 21:53:55 UTC | restart fix (zero incs on global slaves at restart) | 20 September 2019, 21:53:55 UTC |
| 5c10e93 | Janus Juul Eriksen | 20 September 2019, 15:22:55 UTC | fix mbe timings for restart | 20 September 2019, 15:22:55 UTC |
| 37471a3 | Janus Juul Eriksen | 17 September 2019, 11:09:51 UTC | restart fix | 17 September 2019, 11:09:51 UTC |
| 85d052a | Janus Juul Eriksen | 17 September 2019, 10:41:58 UTC | restart fix | 17 September 2019, 10:41:58 UTC |
| df622c8 | Janus Juul Eriksen | 17 September 2019, 10:06:56 UTC | remove tasks from screening code | 17 September 2019, 10:06:56 UTC |
| 5ae5990 | Janus Juul Eriksen | 17 September 2019, 08:54:27 UTC | another attempt | 17 September 2019, 08:54:27 UTC |
| b0a3066 | Janus Juul Eriksen | 17 September 2019, 08:37:29 UTC | restart fixes | 17 September 2019, 08:37:29 UTC |
| dddaff6 | Janus Juul Eriksen | 16 September 2019, 19:03:45 UTC | bugfix | 16 September 2019, 19:03:45 UTC |
| aac4635 | Janus Juul Eriksen | 16 September 2019, 14:22:06 UTC | bugfix | 16 September 2019, 14:22:06 UTC |
| a286e90 | Janus Juul Eriksen | 16 September 2019, 12:37:32 UTC | bugfix | 16 September 2019, 12:37:32 UTC |
| 4327cc9 | Janus Juul Eriksen | 16 September 2019, 12:33:13 UTC | rst_interval -> rst_freq | 16 September 2019, 12:33:13 UTC |
| fe46e6d | Janus Juul Eriksen | 16 September 2019, 12:31:52 UTC | change ndets code | 16 September 2019, 12:31:52 UTC |
| 8328121 | Janus Juul Eriksen | 16 September 2019, 09:29:45 UTC | restart file renaming | 16 September 2019, 09:29:45 UTC |
| 4a26c0a | Janus Juul Eriksen | 15 September 2019, 22:26:38 UTC | new 'ranking' input keyword | 15 September 2019, 22:26:38 UTC |
| 1d1468d | Janus Juul Eriksen | 14 September 2019, 15:46:11 UTC | don't write restart file at tup_idx == 0 | 14 September 2019, 15:46:11 UTC |
| e640526 | Janus Juul Eriksen | 14 September 2019, 15:12:01 UTC | hubbard fixes | 14 September 2019, 15:12:01 UTC |
| 1e8a6f9 | Janus Juul Eriksen | 13 September 2019, 19:51:09 UTC | calculate ndets on slaves | 13 September 2019, 19:51:09 UTC |
| 2ec9290 | Janus Juul Eriksen | 13 September 2019, 10:43:06 UTC | bugfix for screening | 13 September 2019, 10:43:06 UTC |
| 7e2ddf6 | Janus Juul Eriksen | 13 September 2019, 10:16:41 UTC | possible fix | 13 September 2019, 10:16:41 UTC |
| 71d0a18 | Janus Juul Eriksen | 12 September 2019, 19:32:10 UTC | revert last commit | 12 September 2019, 19:32:10 UTC |
| ae4d34e | Janus Juul Eriksen | 12 September 2019, 19:24:30 UTC | more debugging | 12 September 2019, 19:24:30 UTC |
| 2ae39c5 | Janus Juul Eriksen | 12 September 2019, 14:06:17 UTC | debugging | 12 September 2019, 14:06:17 UTC |
| 2fb84d4 | Janus Juul Eriksen | 12 September 2019, 13:41:00 UTC | more fixes | 12 September 2019, 13:41:00 UTC |
| ddd5be2 | Janus Juul Eriksen | 12 September 2019, 13:11:14 UTC | typo | 12 September 2019, 13:11:14 UTC |
| cafb81d | Janus Juul Eriksen | 12 September 2019, 13:09:12 UTC | more barriers | 12 September 2019, 13:09:12 UTC |
| 6ecb033 | Janus Juul Eriksen | 12 September 2019, 13:07:29 UTC | reintroduced slaves_avail in screening code | 12 September 2019, 13:07:29 UTC |
| fb0050c | Janus Juul Eriksen | 12 September 2019, 12:59:12 UTC | attempting to fix race condition | 12 September 2019, 12:59:12 UTC |
| 45c4944 | Janus Juul Eriksen | 12 September 2019, 12:47:24 UTC | yet, yet more fixes | 12 September 2019, 12:47:24 UTC |
| 82f5582 | Janus Juul Eriksen | 12 September 2019, 12:42:04 UTC | yet more fixes | 12 September 2019, 12:42:04 UTC |
| 89bbb89 | Janus Juul Eriksen | 12 September 2019, 12:37:53 UTC | more fixes | 12 September 2019, 12:37:53 UTC |
| fb61a04 | Janus Juul Eriksen | 12 September 2019, 12:33:05 UTC | another fix | 12 September 2019, 12:33:05 UTC |
| 0c4b823 | Janus Juul Eriksen | 12 September 2019, 12:24:30 UTC | more fixes | 12 September 2019, 12:24:30 UTC |
| a3af0fc | Janus Juul Eriksen | 12 September 2019, 12:15:12 UTC | another fix | 12 September 2019, 12:15:12 UTC |
| b23d212 | Janus Juul Eriksen | 12 September 2019, 12:10:58 UTC | local master fix | 12 September 2019, 12:10:58 UTC |
| bacf85d | Janus Juul Eriksen | 12 September 2019, 12:08:42 UTC | import parallel in restart.py and kernel.py | 12 September 2019, 12:08:42 UTC |
| 83692b3 | Janus Juul Eriksen | 12 September 2019, 10:39:01 UTC | ready for testing. | 12 September 2019, 10:39:01 UTC |
| 2d72cb7 | Janus Juul Eriksen | 12 September 2019, 09:29:05 UTC | screening phase | 12 September 2019, 09:29:05 UTC |
| 0a27118 | Janus Juul Eriksen | 12 September 2019, 09:17:25 UTC | increments | 12 September 2019, 09:17:25 UTC |
| 4fe78ae | Janus Juul Eriksen | 12 September 2019, 09:01:12 UTC | hcore, vhf, and eri | 12 September 2019, 09:01:12 UTC |
| 1ccbb59 | Janus Juul Eriksen | 12 September 2019, 08:39:12 UTC | change to mpi interfaces | 12 September 2019, 08:39:12 UTC |
| 1b808bc | Janus Juul Eriksen | 12 September 2019, 08:24:27 UTC | WIP toward multi-node, shared mem | 12 September 2019, 08:24:27 UTC |
| 8929532 | Janus Juul Eriksen | 11 September 2019, 14:28:26 UTC | clean-up | 11 September 2019, 14:28:26 UTC |
| 308fb36 | Janus Juul Eriksen | 11 September 2019, 14:24:30 UTC | property calculations restored | 11 September 2019, 14:24:30 UTC |
| 67fb161 | Janus Juul Eriksen | 11 September 2019, 13:46:11 UTC | restore property calculations. | 11 September 2019, 13:46:11 UTC |
| f1fd4c4 | Janus Juul Eriksen | 11 September 2019, 12:49:54 UTC | restart functionality restored | 11 September 2019, 12:49:54 UTC |
| 93f321c | Janus Juul Eriksen | 11 September 2019, 09:29:35 UTC | distinguish between task_idx, tup_idx, and inc_idx | 11 September 2019, 09:29:35 UTC |
| 34211f7 | Janus Juul Eriksen | 10 September 2019, 21:33:20 UTC | remove reduce and allreduce functions | 10 September 2019, 21:33:20 UTC |
| 47d1d41 | Janus Juul Eriksen | 10 September 2019, 21:31:02 UTC | polish | 10 September 2019, 21:31:02 UTC |
| bdf1a15 | Janus Juul Eriksen | 10 September 2019, 21:17:24 UTC | restore restart functionality | 10 September 2019, 21:17:24 UTC |
| f2c59a9 | Janus Juul Eriksen | 10 September 2019, 14:02:31 UTC | integrals also in shared mem | 10 September 2019, 14:02:31 UTC |
| 2d256c9 | Janus Juul Eriksen | 10 September 2019, 12:20:38 UTC | don't communicate tuples | 10 September 2019, 12:20:38 UTC |
| 3a03b53 | Janus Juul Eriksen | 10 September 2019, 10:57:30 UTC | WIP on tuples in shared mem | 10 September 2019, 10:57:30 UTC |
| 219645b | Janus Juul Eriksen | 10 September 2019, 09:13:19 UTC | more clean-up | 10 September 2019, 09:13:19 UTC |
| 28823b4 | Janus Juul Eriksen | 10 September 2019, 09:12:01 UTC | clean-up | 10 September 2019, 09:12:01 UTC |
| ce2cbdf | Janus Juul Eriksen | 10 September 2019, 07:38:40 UTC | hashes in shared mem | 10 September 2019, 07:38:40 UTC |
| ea316db | Janus Juul Eriksen | 09 September 2019, 12:44:13 UTC | WIP on increments - restart disabled for now... | 09 September 2019, 12:44:13 UTC |
| d69b491 | Janus Juul Eriksen | 09 September 2019, 10:05:42 UTC | work on increments | 09 September 2019, 10:05:42 UTC |
| fb77ede | Janus Juul Eriksen | 09 September 2019, 08:21:02 UTC | remove unnecessary input argument to _sum() | 09 September 2019, 08:21:02 UTC |
| 0309154 | Janus Juul Eriksen | 07 September 2019, 21:55:22 UTC | change to reduce in parallel.py | 07 September 2019, 21:55:22 UTC |
| 42df855 | Janus Juul Eriksen | 02 September 2019, 10:35:29 UTC | new restart code | 02 September 2019, 10:35:29 UTC |
| 22e7308 | Janus Juul Eriksen | 30 August 2019, 14:48:45 UTC | remove non-blocking mpi | 30 August 2019, 14:48:45 UTC |
| 3b8c3b7 | Janus Juul Eriksen | 30 August 2019, 14:46:40 UTC | re-introduce status bar | 30 August 2019, 14:46:40 UTC |
| a38dbe0 | Janus Juul Eriksen | 22 July 2019, 09:14:48 UTC | rst logical | 22 July 2019, 09:14:48 UTC |
| 38d7b83 | Janus Juul Eriksen | 22 July 2019, 09:05:50 UTC | do not store ndets | 22 July 2019, 09:05:50 UTC |
| 0c9e4c5 | Janus Juul Eriksen | 12 July 2019, 13:50:37 UTC | restart fix | 12 July 2019, 13:50:37 UTC |
| 54c2a0e | Janus Juul Eriksen | 12 July 2019, 13:48:10 UTC | remove tuples for all lower orders | 12 July 2019, 13:48:10 UTC |
| 8f42fc5 | Janus Juul Eriksen | 12 July 2019, 12:59:23 UTC | insert date & time | 12 July 2019, 12:59:23 UTC |
| 74393a1 | Janus Juul Eriksen | 12 July 2019, 12:51:25 UTC | allow for blocking mpi | 12 July 2019, 12:51:25 UTC |
| ed7524d | Janus Juul Eriksen | 08 July 2019, 11:01:24 UTC | impl. gatherv op as a point-2-point op instead | 08 July 2019, 11:01:24 UTC |
| f2bf8ba | Janus Juul Eriksen | 01 July 2019, 16:36:36 UTC | insert python3+ check | 01 July 2019, 16:36:36 UTC |
| 048ec7f | Janus Juul Eriksen | 26 June 2019, 08:33:12 UTC | do not reorder tuples in mbe | 26 June 2019, 08:33:12 UTC |
| a8e8338 | Janus Juul Eriksen | 25 June 2019, 13:44:03 UTC | comments | 25 June 2019, 13:44:03 UTC |
| d4f2e01 | Janus Juul Eriksen | 19 June 2019, 22:21:29 UTC | np.int32 bugfix for casscf references | 19 June 2019, 22:21:29 UTC |
| d76528b | Janus Juul Eriksen | 18 June 2019, 08:16:37 UTC | fix bug in n_pi_orbs | 18 June 2019, 08:16:37 UTC |
| b708c0f | Janus Juul Eriksen | 17 June 2019, 14:38:25 UTC | include pi-prune info in results table | 17 June 2019, 14:38:25 UTC |
| e241aa1 | Janus Juul Eriksen | 17 June 2019, 14:34:10 UTC | PI_THRES = 1.0e-04 once again | 17 June 2019, 14:34:10 UTC |
| 0e4cb9b | Janus Juul Eriksen | 17 June 2019, 13:27:15 UTC | remove legends in plots | 17 June 2019, 13:27:15 UTC |
| 9e5143e | Janus Juul Eriksen | 17 June 2019, 11:05:02 UTC | fix to last commit | 17 June 2019, 11:05:02 UTC |
| c5addfa | Janus Juul Eriksen | 17 June 2019, 10:45:58 UTC | WIP on new pruning | 17 June 2019, 10:45:58 UTC |
| 3b9cc7b | Janus Juul Eriksen | 14 June 2019, 14:38:28 UTC | more complete pi-pruning ready for testing | 14 June 2019, 14:38:28 UTC |
| ac84c36 | Janus Juul Eriksen | 14 June 2019, 14:37:07 UTC | only use non-blocking mpi in mbe.py | 14 June 2019, 14:37:07 UTC |
| 2e7bbf4 | Janus Juul Eriksen | 14 June 2019, 13:34:32 UTC | minor style update to system.py | 14 June 2019, 13:34:32 UTC |
| fc8071e | Janus Juul Eriksen | 06 June 2019, 09:43:29 UTC | another casscf fix | 06 June 2019, 09:43:29 UTC |
| 3bece81 | Janus Juul Eriksen | 06 June 2019, 08:58:25 UTC | fix for casscf reference | 06 June 2019, 08:58:25 UTC |
| 7d4d3eb | Janus Juul Eriksen | 05 June 2019, 13:59:46 UTC | small fix in init_tup | 05 June 2019, 13:59:46 UTC |
| 3e0a306 | Janus Juul Eriksen | 31 May 2019, 08:01:21 UTC | rst print fix | 31 May 2019, 08:01:21 UTC |
| 6f3ec4f | Janus Juul Eriksen | 29 May 2019, 09:08:32 UTC | bugfix | 29 May 2019, 09:08:32 UTC |
| b0dcadd | Janus Juul Eriksen | 28 May 2019, 21:53:52 UTC | reverted seed commit + communicate slaves_needed in screen | 28 May 2019, 21:53:52 UTC |
