Skip to content

Commit

Permalink
adapt changelog and bump version
Browse files Browse the repository at this point in the history
  • Loading branch information
bast committed May 26, 2021
1 parent 5b6a1ac commit 24c791e
Show file tree
Hide file tree
Showing 4 changed files with 15 additions and 3 deletions.
11 changes: 11 additions & 0 deletions CHANGES.rst
Expand Up @@ -4,6 +4,17 @@ Changelog
=========


Version 2.1.0
-------------

Released on 2021-05-27.

- Add Krack-Köster radial grid (`radial_grid_kk`).
- Rename `radial_grid` to `radial_grid_lmg`.
- Make it possible to evaluate LMG grid by basis set name
(`radial_grid_lmg_bse`).


Version 2.0.2
-------------

Expand Down
2 changes: 1 addition & 1 deletion Cargo.lock

Some generated files are not rendered by default. Learn more about how customized files appear on GitHub.

2 changes: 1 addition & 1 deletion Cargo.toml
@@ -1,6 +1,6 @@
[package]
name = "numgrid"
version = "2.0.2"
version = "2.1.0"
authors = ["Radovan Bast <bast@users.noreply.github.com>"]
description = "Numerical integration grid for molecules."
license = "MPL-2.0"
Expand Down
3 changes: 2 additions & 1 deletion README.rst
Expand Up @@ -73,7 +73,7 @@ author(s)::
month = {1},
year = {2021},
publisher = {Zenodo},
version = {v2.0.2},
version = {v2.1.0},
doi = {10.5281/zenodo.1470276},
url = {https://doi.org/10.5281/zenodo.1470276}
}
Expand Down Expand Up @@ -322,6 +322,7 @@ Radial grid
===========

Two choices are available:

- Lindh-Malmqvist-Gagliardi (https://dx.doi.org/10.1007/s002140100263)
- Krack-Köster (https://doi.org/10.1063/1.475719)

Expand Down

0 comments on commit 24c791e

Please sign in to comment.