629856f | Jens Jørgen Mortensen | 11 January 2021, 16:49:42 UTC | Merge branch 'use-fixed_density' into 'master' Draft: Do a modern fixed_density calculation See merge request mortengjerding/asr!383 | 11 January 2021, 16:49:42 UTC |
8d0c077 | Jens Jørgen Mortensen | 11 January 2021, 16:48:38 UTC | Do a modern fixed_density calculation | 11 January 2021, 16:48:38 UTC |
ec13db8 | Morten Gjerding | 08 January 2021, 14:47:38 UTC | Merge branch 'update-therm-class' into 'master' Update thermodynamic stability classifier definition See merge request mortengjerding/asr!382 | 08 January 2021, 14:47:38 UTC |
4e705f3 | Morten Gjerding | 08 January 2021, 14:28:58 UTC | flake8 | 08 January 2021, 14:28:58 UTC |
527a8dc | Morten Gjerding | 07 January 2021, 13:56:58 UTC | Merge branch 'fix-emasses-210107' into 'master' Fix emasses validate step See merge request mortengjerding/asr!380 | 07 January 2021, 13:56:58 UTC |
a9ea9a0 | Morten Gjerding | 07 January 2021, 13:10:46 UTC | Merge branch 'fix-hse-missing-keys' into 'master' Fix missing keys in HSE calcs with no BG See merge request mortengjerding/asr!379 | 07 January 2021, 13:10:46 UTC |
528f71f | Morten Gjerding | 07 January 2021, 13:09:24 UTC | Fix emasses validate step | 07 January 2021, 13:09:24 UTC |
ece8267 | Morten Gjerding | 07 January 2021, 11:52:29 UTC | Fix missing keys in HSE calcs with no BG | 07 January 2021, 11:52:29 UTC |
31521c7 | Morten Gjerding | 06 January 2021, 15:06:07 UTC | Update thermodynamic stability classifier definition | 06 January 2021, 15:06:07 UTC |
529f78c | Morten Gjerding | 18 December 2020, 08:27:51 UTC | Merge branch 'remove-missing-keys-warning' into 'master' Remove missing keys warnings See merge request mortengjerding/asr!376 | 18 December 2020, 08:27:51 UTC |
ce900de | Morten Gjerding | 18 December 2020, 07:59:16 UTC | Remove missing keys warnings | 18 December 2020, 07:59:16 UTC |
02ae8c5 | Morten Gjerding | 17 December 2020, 17:18:49 UTC | Merge branch 'update-docs-20201217' into 'master' Update docs 20201217 See merge request mortengjerding/asr!375 | 17 December 2020, 17:18:49 UTC |
a70aaa0 | Morten Gjerding | 17 December 2020, 16:59:09 UTC | Fix doctest | 17 December 2020, 16:59:09 UTC |
c12b122 | Morten Gjerding | 17 December 2020, 16:49:26 UTC | Remove uninted conf file | 17 December 2020, 16:49:26 UTC |
3277ef3 | Morten Gjerding | 17 December 2020, 16:30:55 UTC | Add ASR 1.0 presentation | 17 December 2020, 16:30:55 UTC |
b1ad5b7 | Morten Gjerding | 17 December 2020, 16:18:11 UTC | Update available recipes list | 17 December 2020, 16:18:11 UTC |
a0bb71f | Morten Gjerding | 15 December 2020, 10:34:40 UTC | Merge branch 'asr-ase-database-interface' into 'master' Asr ase database interface See merge request mortengjerding/asr!373 | 15 December 2020, 10:34:40 UTC |
a2a6761 | Jens Jørgen Mortensen | 11 December 2020, 09:07:18 UTC | Use only two digits for Bader charges | 11 December 2020, 09:07:18 UTC |
f9ebcce | Morten Gjerding | 07 December 2020, 18:29:44 UTC | Merge branch 'fix-fermisurface-results-object' into 'master' Fix fermisurface results object See merge request mortengjerding/asr!372 | 07 December 2020, 18:29:44 UTC |
941e66f | Morten Gjerding | 07 December 2020, 13:25:57 UTC | Improve recipe list documentation | 07 December 2020, 13:25:57 UTC |
6f9d250 | Morten Gjerding | 07 December 2020, 11:26:49 UTC | Make guide for retrieving results from database | 07 December 2020, 11:26:49 UTC |
11f07e7 | Morten Gjerding | 07 December 2020, 10:35:22 UTC | Add test of Fermi surface | 07 December 2020, 10:35:22 UTC |
7e9dad0 | Morten Gjerding | 07 December 2020, 10:35:06 UTC | Fix fermi surface calculation | 07 December 2020, 10:35:06 UTC |
52715c5 | Morten Gjerding | 07 December 2020, 10:34:54 UTC | Improve to1bz mock | 07 December 2020, 10:34:54 UTC |
3d19bcf | Morten Gjerding | 03 December 2020, 13:00:45 UTC | Merge branch 'asr-gs-extremum-plot-3d' into 'master' Use time reversal symmetry as well See merge request mortengjerding/asr!370 | 03 December 2020, 13:00:45 UTC |
33a5c56 | Morten Gjerding | 03 December 2020, 12:40:58 UTC | Use time reversal symmetry as well | 03 December 2020, 12:40:58 UTC |
ec92f82 | Morten Gjerding | 03 December 2020, 12:13:24 UTC | Merge branch 'asr-gs-extremum-plot-3d' into 'master' Fix VBM and CBM plots in 3D See merge request mortengjerding/asr!369 | 03 December 2020, 12:13:24 UTC |
2d54739 | Morten Gjerding | 03 December 2020, 10:52:21 UTC | Make extremums be plotted the correct way in 3D arrrhg | 03 December 2020, 10:52:21 UTC |
fc7ebe8 | Morten Gjerding | 02 December 2020, 09:25:54 UTC | Merge branch 'fix-chc-webpanel' into 'master' Some fixes to the chc webpanel See merge request mortengjerding/asr!364 | 02 December 2020, 09:25:54 UTC |
1f47377 | Morten Gjerding | 01 December 2020, 16:58:40 UTC | Merge branch 'fix-magstate-webpanel' into 'master' Fix multiple webpanels See merge request mortengjerding/asr!367 | 01 December 2020, 16:58:40 UTC |
430602d | Morten Gjerding | 01 December 2020, 16:40:59 UTC | Fix piezoelectric tensor labels | 01 December 2020, 16:40:59 UTC |
1a02dad | Morten Gjerding | 01 December 2020, 16:37:43 UTC | Make bandstructure webpanel description | 01 December 2020, 16:37:43 UTC |
d8dbf31 | Morten Gjerding | 01 December 2020, 16:24:31 UTC | Make general panel information prettier | 01 December 2020, 16:24:31 UTC |
a955134 | Morten Gjerding | 01 December 2020, 15:48:53 UTC | Fix webpanel | 01 December 2020, 15:48:53 UTC |
c1f04d1 | Morten Gjerding | 01 December 2020, 14:59:06 UTC | Describe bader panel | 01 December 2020, 14:59:06 UTC |
e0c92bc | Morten Gjerding | 01 December 2020, 14:54:44 UTC | BSE panel description | 01 December 2020, 14:54:44 UTC |
9ee6abe | Morten Gjerding | 01 December 2020, 14:52:34 UTC | Make piezoelectric tensor description | 01 December 2020, 14:52:34 UTC |
0805189 | Morten Gjerding | 01 December 2020, 14:49:37 UTC | Raman panel description | 01 December 2020, 14:49:37 UTC |
a9e01f1 | Morten Gjerding | 01 December 2020, 14:49:10 UTC | Infrared pol panel description | 01 December 2020, 14:49:10 UTC |
2c32106 | Morten Gjerding | 01 December 2020, 14:43:45 UTC | Polarizability panel description | 01 December 2020, 14:43:45 UTC |
05c81c4 | Morten Gjerding | 01 December 2020, 14:41:44 UTC | Borncharge panel description | 01 December 2020, 14:41:44 UTC |
e88be8d | Morten Gjerding | 01 December 2020, 14:38:59 UTC | GW panel description | 01 December 2020, 14:38:59 UTC |
22b5919 | Morten Gjerding | 01 December 2020, 14:34:24 UTC | Fermisurface panel descriptions | 01 December 2020, 14:34:24 UTC |
c35dd57 | Morten Gjerding | 01 December 2020, 14:31:19 UTC | Panel PDOS and projected bs descriptions | 01 December 2020, 14:31:19 UTC |
c1ddf19 | Morten Gjerding | 01 December 2020, 14:26:03 UTC | Describe effective masses panel | 01 December 2020, 14:26:03 UTC |
18c63c2 | Morten Gjerding | 01 December 2020, 14:24:22 UTC | Add link to Daniele's article | 01 December 2020, 14:24:22 UTC |
1072f89 | Morten Gjerding | 01 December 2020, 14:22:54 UTC | Describe magnetic anisotropy | 01 December 2020, 14:22:54 UTC |
d67f38c | Morten Gjerding | 01 December 2020, 14:18:26 UTC | GS panel description | 01 December 2020, 14:18:26 UTC |
d6199c5 | Morten Gjerding | 01 December 2020, 14:17:07 UTC | Phonon panel description | 01 December 2020, 14:17:07 UTC |
b6847b8 | Morten Gjerding | 01 December 2020, 14:15:56 UTC | Stiffness panel description | 01 December 2020, 14:15:56 UTC |
5bee888 | Morten Gjerding | 01 December 2020, 14:14:17 UTC | Make some general panel descriptions | 01 December 2020, 14:14:17 UTC |
b06b541 | Morten Gjerding | 01 December 2020, 13:08:54 UTC | Fix excluding keys | 01 December 2020, 13:08:54 UTC |
76b82b8 | Morten Gjerding | 01 December 2020, 13:08:45 UTC | Typo | 01 December 2020, 13:08:45 UTC |
a9baa3f | Morten Gjerding | 01 December 2020, 13:00:18 UTC | Fix z-order of app div | 01 December 2020, 13:00:18 UTC |
54e694f | Morten Gjerding | 01 December 2020, 12:32:07 UTC | Fix webpanel string | 01 December 2020, 12:32:07 UTC |
39b7a17 | Morten Gjerding | 01 December 2020, 12:28:19 UTC | Merge branch 'fix-magstate-webpanel' into 'master' Print is_magnetic instead of magstate See merge request mortengjerding/asr!366 | 01 December 2020, 12:28:19 UTC |
47d0168 | Morten Gjerding | 01 December 2020, 11:32:30 UTC | Print is_magnetic instead of magstate | 01 December 2020, 11:32:30 UTC |
4aadecd | Morten Gjerding | 01 December 2020, 11:26:49 UTC | Merge branch 'fix-structureinfo-berry' into 'master' Fix structureinfo and berry webpanels See merge request mortengjerding/asr!365 | 01 December 2020, 11:26:49 UTC |
49a371e | Morten Gjerding | 01 December 2020, 10:30:34 UTC | Fix berry webpanel if results are incomplete | 01 December 2020, 10:30:34 UTC |
a8c5d7d | Morten Gjerding | 01 December 2020, 10:24:53 UTC | Typo | 01 December 2020, 10:24:53 UTC |
c3964c3 | Morten Gjerding | 01 December 2020, 10:24:32 UTC | Fix structureinfo printing of COD id | 01 December 2020, 10:24:32 UTC |
54d1acd | Morten Gjerding | 26 November 2020, 15:08:46 UTC | Some fixes to the chc webpanel | 26 November 2020, 15:08:46 UTC |
ff8014f | Morten Gjerding | 26 November 2020, 15:02:19 UTC | Merge branch 'fix-emasses-webpanel-double-printing' into 'master' Give validate a separate result class without a webpanel See merge request mortengjerding/asr!363 | 26 November 2020, 15:02:19 UTC |
bbf89f6 | Morten Gjerding | 26 November 2020, 14:40:13 UTC | Fix emasses printing of webpanels twice | 26 November 2020, 14:40:13 UTC |
2f88f11 | Morten Gjerding | 26 November 2020, 14:37:52 UTC | Merge branch 'fix-jsmol-bootstrap-import-order' into 'master' Fix jsmol bootstrap import order See merge request mortengjerding/asr!362 | 26 November 2020, 14:37:52 UTC |
4a68b7c | Morten Gjerding | 26 November 2020, 14:22:58 UTC | Give validate a separate result class without a webpanel | 26 November 2020, 14:22:58 UTC |
531f574 | Morten Gjerding | 26 November 2020, 14:18:36 UTC | Fix max width for popover such that it doesn't overlap with jsmol app | 26 November 2020, 14:18:36 UTC |
af357c1 | Morten Gjerding | 26 November 2020, 14:17:33 UTC | jsmol should be imported berfore bootstrap | 26 November 2020, 14:17:33 UTC |
85dd109 | Morten Gjerding | 26 November 2020, 14:04:34 UTC | Merge branch 'fix-berry-webpanel' into 'master' Fix berry webpanel See merge request mortengjerding/asr!361 | 26 November 2020, 14:04:34 UTC |
7dac288 | Morten Gjerding | 26 November 2020, 13:42:08 UTC | Fix data representation with missing keys | 26 November 2020, 13:42:08 UTC |
db4f133 | Morten Gjerding | 26 November 2020, 13:27:00 UTC | Fix berry webpanel | 26 November 2020, 13:27:00 UTC |
d990f8e | Morten Gjerding | 26 November 2020, 12:11:53 UTC | Merge branch 'shg' into 'master' SHG and shift current recipe See merge request mortengjerding/asr!356 | 26 November 2020, 12:11:53 UTC |
b799ca8 | Morten Gjerding | 26 November 2020, 12:08:41 UTC | Merge branch 'fix-exchange' into 'master' Fix exchange See merge request mortengjerding/asr!359 | 26 November 2020, 12:08:41 UTC |
32b501c | Morten Gjerding | 26 November 2020, 11:02:30 UTC | Fix typo in berry webpanel | 26 November 2020, 11:02:30 UTC |
2e84fc1 | Morten Gjerding | 26 November 2020, 10:42:54 UTC | Merge branch 'make-structureinfo-data-descriptions' into 'master' Make structureinfo data descriptions See merge request mortengjerding/asr!360 | 26 November 2020, 10:42:54 UTC |
30de59f | Morten Gjerding | 26 November 2020, 10:26:25 UTC | Make piezoelectrictensor tests xfail. This will be fixed when we fix the setup strains recipe | 26 November 2020, 10:26:25 UTC |
707cf47 | Morten Gjerding | 24 November 2020, 16:01:40 UTC | Make question marks on summary webpanel | 24 November 2020, 16:01:40 UTC |
93d26e2 | Jens Jørgen Mortensen | 24 November 2020, 14:02:51 UTC | Small Bader web panel fixes | 24 November 2020, 14:02:51 UTC |
4f55eab | Morten Gjerding | 24 November 2020, 13:35:36 UTC | Make crystal type data descriptor | 24 November 2020, 13:35:36 UTC |
56bad65 | Morten Gjerding | 23 November 2020, 20:04:57 UTC | Merge branch 'emass-subscript' into 'master' Change emass subscript from e to 0 See merge request mortengjerding/asr!358 | 23 November 2020, 20:04:57 UTC |
5c8ed9f | Asbjorn Rasmussen | 23 November 2020, 13:34:21 UTC | Change emass subscript from e to 0 | 23 November 2020, 13:34:21 UTC |
0a9a0ad | Morten Gjerding | 19 November 2020, 16:31:37 UTC | Merge branch 'fix-help-layout' into 'master' Update templates and fix help button on panel See merge request mortengjerding/asr!357 | 19 November 2020, 16:31:37 UTC |
e1d116a | Morten Gjerding | 19 November 2020, 14:46:44 UTC | Update templates and fix help button on panel | 19 November 2020, 14:46:44 UTC |
09482a0 | Alireza Taghizadeh | 19 November 2020, 09:23:25 UTC | Fix style | 19 November 2020, 09:23:25 UTC |
3544e7d | Alireza Taghizadeh | 19 November 2020, 09:20:25 UTC | Fix typos and dimension | 19 November 2020, 09:20:25 UTC |
97ee43d | Morten Gjerding | 19 November 2020, 08:30:00 UTC | Merge branch 'emassmare' into 'master' fix emasses return type See merge request mortengjerding/asr!355 | 19 November 2020, 08:30:00 UTC |
62632b6 | Morten Gjerding | 19 November 2020, 08:05:07 UTC | Make consistent return type | 19 November 2020, 08:05:07 UTC |
5be2928 | Alireza Taghizadeh | 19 November 2020, 07:39:35 UTC | Plot changes slightly, add a new input parameter | 19 November 2020, 07:39:35 UTC |
f037bb0 | Morten Gjerding | 18 November 2020, 14:39:26 UTC | fix emasses return type | 18 November 2020, 14:39:26 UTC |
65e7646 | Morten Gjerding | 18 November 2020, 13:58:48 UTC | Merge branch 'emassmare' into 'master' Add MARE to emasses See merge request mortengjerding/asr!352 | 18 November 2020, 13:58:48 UTC |
edecac4 | Morten Gjerding | 18 November 2020, 13:31:22 UTC | Dont use read_json in webpanel | 18 November 2020, 13:31:22 UTC |
80b9f93 | Morten Gjerding | 18 November 2020, 12:53:58 UTC | Merge branch 'pdos-webpanel' into 'master' Pdos webpanel See merge request mortengjerding/asr!353 | 18 November 2020, 12:53:58 UTC |
3840206 | Morten Gjerding | 18 November 2020, 12:51:41 UTC | Merge branch 'fix-gw-dependencies' into 'master' Fix gw dependencies See merge request mortengjerding/asr!354 | 18 November 2020, 12:51:41 UTC |
e44ac02 | Morten Gjerding | 18 November 2020, 12:31:23 UTC | Fix writing of data keys | 18 November 2020, 12:31:23 UTC |
95bd19d | Morten Gjerding | 18 November 2020, 09:10:05 UTC | Fix gw dependencies | 18 November 2020, 09:10:05 UTC |
fe97aea | Thorbjørn Skovhus | 18 November 2020, 07:25:42 UTC | flake8 | 18 November 2020, 07:25:42 UTC |
d473a96 | Thorbjørn Skovhus | 17 November 2020, 17:32:02 UTC | added dependency comment and showed gs kpts and nbands | 17 November 2020, 17:32:02 UTC |
dcac623 | Thorbjørn Skovhus | 17 November 2020, 17:28:16 UTC | add gs@calculate as a dependency in the parameter description of the projected band structure plot | 17 November 2020, 17:28:16 UTC |
5dfda46 | Thorbjørn Skovhus | 17 November 2020, 17:22:01 UTC | add gs@calculate as a dependency in the parameter description of the pdos plot | 17 November 2020, 17:22:01 UTC |
73c986a | Thorbjørn Skovhus | 17 November 2020, 17:09:04 UTC | added : | 17 November 2020, 17:09:04 UTC |