Skip to content

Commit 11e39bc

Browse files
authored
Merge pull request #49 from WMD-group/scissor_update
Version `2.1.0`
2 parents e952003 + 657d6e8 commit 11e39bc

File tree

13 files changed

+746
-803
lines changed

13 files changed

+746
-803
lines changed

CHANGELOG.rst

Lines changed: 6 additions & 0 deletions
Original file line numberDiff line numberDiff line change
@@ -1,6 +1,12 @@
11
Change log
22
==========
33

4+
v2.1.0
5+
~~~~~~
6+
- Add `bg` option to `TASGenerator.from_vasp_outputs()` to allow scissor shifting of the bandgap to match experiment.
7+
- Implement vectorised band filtering functions, massive speedup in processing times.
8+
- Implement memory sharing for large arrays within multiprocessing.
9+
410
v2.0.1
511
~~~~~~
612
- Minor documentation and website updates.

docs/source/conf.py

Lines changed: 3 additions & 3 deletions
Original file line numberDiff line numberDiff line change
@@ -13,7 +13,7 @@
1313
import os
1414
import sys
1515

16-
sys.path.insert(0, os.path.abspath('../../'))
16+
sys.path.insert(0, os.path.abspath("../../"))
1717
# from pytaser import __version__
1818

1919

@@ -50,7 +50,7 @@
5050
# List of patterns, relative to source directory, that match files and
5151
# directories to ignore when looking for source files.
5252
# This pattern also affects html_static_path and html_extra_path.
53-
exclude_patterns = ['_build', 'Thumbs.db', '.DS_Store']
53+
exclude_patterns = ["_build", "Thumbs.db", ".DS_Store"]
5454

5555
# -- Options for HTML output -------------------------------------------------
5656

@@ -66,7 +66,7 @@
6666
"path_to_docs": "docs/source",
6767
"use_repository_button": True,
6868
"use_issues_button": True,
69-
"use_edit_page_button": True, # add button to suggest edits
69+
"use_edit_page_button": True, # add button to suggest edits
7070
"home_page_in_toc": True,
7171
}
7272

examples/PyTASER_DFT_Example.ipynb

Lines changed: 335 additions & 111 deletions
Large diffs are not rendered by default.

0 commit comments

Comments
 (0)