da9652d | lllangWV | 14 June 2023, 20:21:57 UTC | Update README.md readme update | 14 June 2023, 20:21:57 UTC |
3bd85b7 | lllangWV | 14 June 2023, 20:19:35 UTC | Updating README. Added link to older documentation | 14 June 2023, 20:19:35 UTC |
40c20c8 | lllangWV | 10 June 2023, 17:31:54 UTC | doc, .gitignore, README.md updates | 10 June 2023, 17:31:54 UTC |
7811c23 | lllangWV | 10 June 2023, 16:57:30 UTC | Updated readme for version 6.0.0 | 10 June 2023, 16:57:30 UTC |
da0365b | lllangWV | 10 June 2023, 16:48:41 UTC | doc update. | 10 June 2023, 16:48:41 UTC |
248e545 | lllangWV | 25 May 2023, 20:25:11 UTC | Update README.md Updated currently supporting codes | 25 May 2023, 20:25:11 UTC |
c10d3ac | lllangWV | 25 May 2023, 20:05:38 UTC | doc update and non-colinear update | 25 May 2023, 20:05:38 UTC |
9bd2685 | lllangWV | 23 May 2023, 19:41:30 UTC | Update to vasp non-collinear parsing | 23 May 2023, 19:41:30 UTC |
e1dc787 | lllangWV | 23 May 2023, 18:09:52 UTC | FermiSurface3D update | 23 May 2023, 18:09:52 UTC |
a1e061e | lllangWV | 23 May 2023, 14:19:56 UTC | Updated parser.py | 23 May 2023, 14:19:56 UTC |
8ffabe9 | lllangWV | 16 May 2023, 14:24:14 UTC | fermi3d changes | 16 May 2023, 14:24:14 UTC |
c14d12c | lllangWV | 08 May 2023, 19:15:42 UTC | added docs | 08 May 2023, 19:15:42 UTC |
e6ba7a5 | lllangWV | 08 May 2023, 19:14:43 UTC | removed docs and add to main index.rst | 08 May 2023, 19:14:43 UTC |
9164eaf | lllangWV | 08 May 2023, 19:02:44 UTC | doc update | 08 May 2023, 19:02:44 UTC |
53bd29c | lllangWV | 08 May 2023, 18:54:29 UTC | doc updates | 08 May 2023, 18:54:29 UTC |
d8e125a | lllangWV | 08 May 2023, 14:34:47 UTC | Adding docs | 08 May 2023, 14:34:47 UTC |
69b616e | lllangWV | 08 May 2023, 14:34:07 UTC | removing docs | 08 May 2023, 14:34:07 UTC |
cb9a5ff | lllangWV | 08 May 2023, 14:21:59 UTC | doc updates | 08 May 2023, 14:21:59 UTC |
8a5fd3d | lllangWV | 08 May 2023, 14:19:08 UTC | doc updates | 08 May 2023, 14:19:08 UTC |
804782f | lllangWV | 08 May 2023, 14:17:19 UTC | doc updates | 08 May 2023, 14:17:19 UTC |
81cde72 | lllangWV | 08 May 2023, 12:21:28 UTC | Merge pull request #103 from romerogroup/dev Dev | 08 May 2023, 12:21:28 UTC |
f6f4031 | lllangWV | 08 May 2023, 12:19:07 UTC | rebase bug fix | 08 May 2023, 12:19:07 UTC |
2224d03 | lllangWV | 08 May 2023, 12:13:34 UTC | doc updates | 08 May 2023, 12:13:34 UTC |
c2ff86d | lllangWV | 08 May 2023, 11:56:46 UTC | Merge pull request #102 from romerogroup/dev Dev | 08 May 2023, 11:56:46 UTC |
1872d7c | lllangWV | 08 May 2023, 11:53:29 UTC | Updated docs and bug fixes | 08 May 2023, 11:53:29 UTC |
6fddcfb | lllangWV | 01 May 2023, 01:54:06 UTC | Merge pull request #100 from romerogroup/main Updated docs and bug fix with fermi zeroing | 01 May 2023, 01:54:06 UTC |
2a30c8c | lllangWV | 01 May 2023, 01:49:36 UTC | Updated docs and bug fix with fermi zeroing | 01 May 2023, 01:49:36 UTC |
f3a4373 | lllangWV | 30 April 2023, 20:41:16 UTC | Merge pull request #99 from romerogroup/main Making sure main and dev are up to the same commit | 30 April 2023, 20:41:16 UTC |
22ea719 | lllangWV | 30 April 2023, 20:27:02 UTC | Updated gitignore | 30 April 2023, 20:27:02 UTC |
5dc5ade | lllangWV | 30 April 2023, 20:26:12 UTC | Removed reports directory | 30 April 2023, 20:26:12 UTC |
9a00128 | lllangWV | 30 April 2023, 20:23:14 UTC | updated gitignore | 30 April 2023, 20:23:14 UTC |
21acb31 | lllangWV | 30 April 2023, 20:20:23 UTC | qe parser bug fix | 30 April 2023, 20:20:23 UTC |
e05dc84 | Pedram Tavadze | 30 April 2023, 17:30:55 UTC | Merge pull request #98 from romerogroup/dev added elk.py and code-workspace to gitignore | 30 April 2023, 17:30:55 UTC |
00b0348 | Pedram Tavadze | 30 April 2023, 17:29:45 UTC | added elk.py and code-workspace to gitignore | 30 April 2023, 17:29:45 UTC |
45bce62 | Uthpala Herath | 26 April 2023, 07:22:28 UTC | Refactored abinit parser and updated kpath module | 26 April 2023, 07:22:28 UTC |
d821010 | lllangWV | 02 April 2023, 03:39:25 UTC | Added core unit tests | 02 April 2023, 03:39:25 UTC |
443c2d1 | lllangWV | 27 March 2023, 19:38:33 UTC | bug fix | 27 March 2023, 19:38:33 UTC |
2ed0561 | lllangWV | 26 March 2023, 20:24:58 UTC | Updated ebs be able to return scalar gradients of the kpoints grid | 26 March 2023, 20:24:58 UTC |
58a7711 | lllangWV | 18 March 2023, 19:24:05 UTC | Created Parser class. all other parsers will go through this to extract ebs,dos,structure,kpath | 18 March 2023, 19:24:05 UTC |
4287f13 | lllangWV | 17 March 2023, 19:32:12 UTC | Updated abinit parser | 17 March 2023, 19:32:12 UTC |
fcc61fa | lllangWV | 17 March 2023, 15:40:14 UTC | Added pytest foundations | 17 March 2023, 15:40:14 UTC |
3d2e71d | lllangWV | 17 March 2023, 14:30:00 UTC | Added method to download development data. This is used for generating docs and testing | 17 March 2023, 14:30:00 UTC |
58772ba | lllangWV | 17 March 2023, 03:28:52 UTC | Changed examples to have the same directory pathing as downloaded data | 17 March 2023, 03:28:52 UTC |
ee772e5 | lllangWV | 17 March 2023, 00:30:08 UTC | Moved download_examples and and welcome function to utils | 17 March 2023, 00:30:08 UTC |
57aafed | lllangWV | 16 March 2023, 23:40:01 UTC | Updated download_example and tested. | 16 March 2023, 23:40:01 UTC |
d689eef | lllangWV | 16 March 2023, 19:47:49 UTC | Updated .gitignore and removed .vscode | 16 March 2023, 19:47:49 UTC |
1ce211a | lllangWV | 06 March 2023, 21:09:42 UTC | Added compare_bands example and fixed an issue in the qeparser | 06 March 2023, 21:09:42 UTC |
a782b59 | lllangWV | 06 March 2023, 15:05:14 UTC | Doc updates | 06 March 2023, 15:05:14 UTC |
422caf5 | lllangWV | 15 February 2023, 16:26:37 UTC | Added option to specify band colors in fermi 2d | 15 February 2023, 16:26:37 UTC |
2b2d5da | lllangWV | 15 February 2023, 15:05:38 UTC | Added band selection in fermi2d | 15 February 2023, 15:05:38 UTC |
a57f14c | lllangWV | 14 February 2023, 16:21:14 UTC | More doc updates | 14 February 2023, 16:21:14 UTC |
d09858c | lllangWV | 13 February 2023, 01:07:14 UTC | Added orbital projection to fermi 2d. Also added fermi2d examples | 13 February 2023, 01:07:14 UTC |
a1a390d | lllangWV | 09 February 2023, 16:02:19 UTC | Bug fix in Fermi3D | 09 February 2023, 16:02:19 UTC |
425262f | lllangWV | 09 February 2023, 12:47:24 UTC | More doc updates. Changes in IO API and add docstrings to parsers | 09 February 2023, 12:47:24 UTC |
97a82b3 | lllangWV | 06 February 2023, 19:18:27 UTC | More doc updates. A updated api. Added complete doc to core modules. | 06 February 2023, 19:18:27 UTC |
42d04d8 | lllangWV | 05 February 2023, 19:03:21 UTC | More doc changes | 05 February 2023, 19:03:21 UTC |
d117152 | lllangWV | 31 January 2023, 14:16:35 UTC | Added new sphinx _build/html to docs | 31 January 2023, 14:16:35 UTC |
876f4bf | lllangWV | 26 January 2023, 12:52:25 UTC | Started Siesta Parser | 26 January 2023, 12:52:25 UTC |
2c112e3 | lllangWV | 23 January 2023, 14:48:22 UTC | More doc updates | 23 January 2023, 14:48:22 UTC |
bf7cc27 | lllangWV | 13 January 2023, 17:07:24 UTC | Added option to download specific example | 13 January 2023, 17:07:24 UTC |
36f1aa3 | lllangWV | 10 January 2023, 22:48:36 UTC | Added requirements_docs.txt | 10 January 2023, 22:48:36 UTC |
b86ef8e | lllangWV | 10 January 2023, 18:11:07 UTC | Initial dev push | 10 January 2023, 18:11:07 UTC |
850573c | lllangWV | 26 August 2022, 20:00:09 UTC | Update scriptFermi3D.py kpoints ebs.kpoints was assigned to bands keywords in the initialization of FermiSurface3D | 26 August 2022, 20:00:09 UTC |
f867f5e | lllangWV | 26 August 2022, 18:21:56 UTC | Update scriptBandsplot.py changed positional arguments to keywords for Procar parsing | 26 August 2022, 18:21:56 UTC |
203953a | lllangWV | 23 August 2022, 15:49:39 UTC | Update scriptDosplot.py dos_interpolation_factor when initializing VASPXML was set to None, changed interpolation_factor | 23 August 2022, 15:49:39 UTC |
932eedb | lllangWV | 10 August 2022, 18:22:28 UTC | Bug fixes in docs | 10 August 2022, 18:22:28 UTC |
b4ea144 | lllangWV | 10 August 2022, 18:18:28 UTC | Re-adding sphinx files | 10 August 2022, 18:18:28 UTC |
1e30f2d | lllangWV | 10 August 2022, 16:55:02 UTC | Bug fixes | 10 August 2022, 16:55:02 UTC |
7b561e7 | lllangWV | 09 August 2022, 23:31:12 UTC | minor changes | 09 August 2022, 23:31:12 UTC |
b0cafe8 | lllangWV | 09 August 2022, 23:21:32 UTC | Reverting to 7cdbf46 commit | 09 August 2022, 23:21:32 UTC |
75140f8 | Pedram Tavadze | 03 August 2022, 16:32:04 UTC | Merge branch 'master' of https://github.com/romerogroup/pyprocar | 03 August 2022, 16:32:04 UTC |
bc7cd52 | Pedram Tavadze | 03 August 2022, 16:31:21 UTC | middle of documentation | 03 August 2022, 16:31:21 UTC |
7cdbf46 | lllangWV | 26 July 2022, 16:54:39 UTC | Switched v1 __init__ to relative imports instead of absolute imports | 26 July 2022, 16:54:39 UTC |
d36e65f | Pedram Tavadze | 14 June 2022, 14:13:48 UTC | added band reorder function and commented it | 14 June 2022, 14:13:48 UTC |
a1b2cf1 | lllangWV | 08 June 2022, 20:09:39 UTC | Added symmertry use for both quantum espresso and vasp for the fermi surface | 08 June 2022, 20:09:39 UTC |
5a5fa80 | lllangWV | 03 June 2022, 19:19:05 UTC | Added gdown to install_requires in setup.py | 03 June 2022, 19:19:05 UTC |
074c19d | lllangWV | 03 June 2022, 19:02:18 UTC | Experimental: PropertyCalculator. Will be used to calculate derivate and integral properties of bands. | 03 June 2022, 19:02:18 UTC |
0e2ecee | Pedram Tavadze | 01 June 2022, 14:02:09 UTC | ebs, kpath, defaults 1. added __str__ to kpath 2. removed reorder and interpolate from ebs 3. removed e from edos | 01 June 2022, 14:02:09 UTC |
100a669 | Pedram Tavadze | 01 June 2022, 13:58:07 UTC | Update .gitignore | 01 June 2022, 13:58:07 UTC |
ad2e421 | Pedram Tavadze | 01 June 2022, 13:56:23 UTC | Create scriptUnfold.py | 01 June 2022, 13:56:23 UTC |
fc7cab9 | Pedram Tavadze | 01 June 2022, 13:56:19 UTC | Update .gitignore | 01 June 2022, 13:56:19 UTC |
6d5450d | Pedram Tavadze | 01 June 2022, 12:34:48 UTC | added download_examples, and fixed string compar | 01 June 2022, 12:34:48 UTC |
b706034 | Pedram Tavadze | 31 May 2022, 19:44:43 UTC | updated example download | 31 May 2022, 19:44:43 UTC |
92b618a | lllangWV | 20 May 2022, 03:27:28 UTC | New Fermi Surface implementation | 20 May 2022, 03:27:28 UTC |
443a574 | Pedram Tavadze | 17 May 2022, 16:05:43 UTC | added examples to .gitignore | 17 May 2022, 16:05:43 UTC |
5ee38f9 | Pedram Tavadze | 17 May 2022, 16:01:25 UTC | deleted examples | 17 May 2022, 16:01:25 UTC |
2c56ce0 | lllangWV | 15 May 2022, 20:53:13 UTC | Minor bug fixes | 15 May 2022, 20:53:13 UTC |
f62e0d7 | lllangWV | 15 May 2022, 18:24:41 UTC | removed old versions of files. If you still need to use an old version look in the v1 module which contains an old version of pyprocar | 15 May 2022, 18:24:41 UTC |
305b3d6 | lllangWV | 15 May 2022, 18:21:30 UTC | Made version 1 of pyprocar Mar 9, 2021 -commit 43d7cfc301a5ec446c35943188f29a4e0f3a518a | 15 May 2022, 18:21:30 UTC |
1aa984a | lllangWV | 15 May 2022, 18:10:29 UTC | Added typing and more doc strings to various files | 15 May 2022, 18:10:29 UTC |
5e830c6 | lllangWV | 15 May 2022, 15:53:52 UTC | Added type hinting to scriptdosplot | 15 May 2022, 15:53:52 UTC |
e0de952 | Pedram Tavadze | 15 May 2022, 15:34:23 UTC | added some typing in ebs/dos.py | 15 May 2022, 15:34:23 UTC |
df849c8 | lllangWV | 15 May 2022, 03:14:00 UTC | Updated FermiSurface Interface, its Object inheritance, and added type hinting | 15 May 2022, 03:14:00 UTC |
455023a | Pedram Tavadze | 14 May 2022, 04:39:58 UTC | updated todo for individuals | 14 May 2022, 04:39:58 UTC |
b0084ef | Pedram Tavadze | 14 May 2022, 03:36:40 UTC | added todo list for new pyprocar | 14 May 2022, 03:36:40 UTC |
c649b39 | lllangWV | 07 April 2022, 17:27:07 UTC | Updated docs for lobster calcs | 07 April 2022, 17:27:07 UTC |
f716924 | lllangWV | 07 April 2022, 17:06:08 UTC | Added new lobster parser for qe | 07 April 2022, 17:06:08 UTC |
1c7a9f6 | lllangWV | 13 March 2022, 05:55:38 UTC | Bug fixes | 13 March 2022, 05:55:38 UTC |
32f98e9 | lllangWV | 11 March 2022, 00:35:36 UTC | Organized parsers into io folder | 11 March 2022, 00:35:36 UTC |
49946ef | lllangWV | 10 March 2022, 23:44:55 UTC | put pyprocar scripts into scripts folder | 10 March 2022, 23:44:55 UTC |