Skip to content

Commit

Permalink
Bump changelog before release
Browse files Browse the repository at this point in the history
  • Loading branch information
kavanase committed Aug 23, 2023
1 parent 41d5ec3 commit d49479d
Show file tree
Hide file tree
Showing 4 changed files with 19 additions and 1 deletion.
8 changes: 8 additions & 0 deletions CHANGELOG.rst
Original file line number Diff line number Diff line change
@@ -1,5 +1,13 @@
Change Log
==========

v.2.0.0
----------
- Major overhaul to rebase onto the new `pymatgen` defects code (`>v2022.7.25`).
- Add documentation (https://doped.readthedocs.io/en/latest)
- Add `DefectsGenerator` class with major upgrade in functionality.
- Add `DefectsSet` classes in `vasp.py`

v.1.1.2
----------
- Cap `numpy` to `1.23` to avoid `pymatgen` dependency issues.
Expand Down
2 changes: 1 addition & 1 deletion docs/Tips.rst
Original file line number Diff line number Diff line change
Expand Up @@ -24,7 +24,7 @@ either:
is the case.

Difficult Structural Relaxations
-------------------
--------------------------------

If defect supercell relaxations do not converge after multiple continuation calculations
(i.e. ``cp``-ing ``CONTCAR`` to ``POSCAR`` and resubmitting the job), this is likely due to an error in
Expand Down
1 change: 1 addition & 0 deletions docs/changelog_link.rst
Original file line number Diff line number Diff line change
@@ -0,0 +1 @@
.. include:: ../CHANGELOG.rst
9 changes: 9 additions & 0 deletions docs/index.rst
Original file line number Diff line number Diff line change
Expand Up @@ -164,11 +164,20 @@ Studies using ``doped``

.. toctree::
:hidden:
:caption: Usage
:maxdepth: 4

Installation
Python API <doped>
Tutorials
Tips

.. toctree::
:hidden:
:caption: Information
:maxdepth: 1

Contributing
Code_Compatibility
changelog_link
doped on GitHub <https://github.com/SMTG-UCL/doped>

0 comments on commit d49479d

Please sign in to comment.