What's Changed
- update from the main branch by @jcwang587 in #121
- add test case for neb by @jcwang587 in #122
- Update rdkit requirement from 2024.3.1 to 2024.3.3 by @dependabot in #123
- Bump sphinx from 7.3.7 to 7.4.0 by @dependabot in #124
- Bump sphinx from 7.4.0 to 7.4.4 by @dependabot in #125
- Update pyarrow requirement from 16.1.0 to 17.0.0 by @dependabot in #127
- Bump sphinx from 7.4.4 to 7.4.5 by @dependabot in #126
- Bump sphinx from 7.4.5 to 7.4.6 by @dependabot in #129
- Update pymatgen requirement from 2024.6.10 to 2024.7.18 by @dependabot in #128
- Bump sphinx-autoapi from 3.1.2 to 3.2.0 by @dependabot in #132
- Bump sphinx from 7.4.6 to 7.4.7 by @dependabot in #131
- Update pytest requirement from 8.2.2 to 8.3.1 by @dependabot in #130
- Update plotly requirement from 5.22.0 to 5.23.0 by @dependabot in #134
- Bump sphinx-autoapi from 3.2.0 to 3.2.1 by @dependabot in #133
- update dev by @jcwang587 in #135
- Bump sphinx from 7.4.7 to 8.0.2 by @dependabot in #137
- Update pytest requirement from 8.3.1 to 8.3.2 by @dependabot in #136
- merge from main by @jcwang587 in #138
- Update rdkit requirement from 2024.3.3 to 2024.3.4 by @dependabot in #140
- Update pyyaml requirement from 6.0.1 to 6.0.2 by @dependabot in #139
- Update rdkit requirement from 2024.3.4 to 2024.3.5 by @dependabot in #141
- Update pymatgen requirement from 2024.7.18 to 2024.8.9 by @dependabot in #143
- merge from the main by @jcwang587 in #144
- bump dependency version by @jcwang587 in #145
- Bump sphinx-autoapi from 3.2.1 to 3.3.0 by @dependabot in #148
- Update plotly requirement from 5.23.0 to 5.24.0 by @dependabot in #147
- Update rich requirement from 13.7.1 to 13.8.0 by @dependabot in #146
- Update plotly requirement from 5.24.0 to 5.24.1 by @dependabot in #153
- Update pytest requirement from 8.3.2 to 8.3.3 by @dependabot in #152
- Bump sphinx-autoapi from 3.3.0 to 3.3.2 by @dependabot in #151
- Update pymatgen requirement from 2024.8.9 to 2024.9.17.1 by @dependabot in #150
- Update statsmodels requirement from 0.14.2 to 0.14.3 by @dependabot in #149
- Bump sphinx from 8.0.2 to 8.1.3 by @dependabot in #158
- Update dash requirement from 2.17.1 to 2.18.1 by @dependabot in #157
- Update pytest-cov requirement from 5.0.0 to 6.0.0 by @dependabot in #156
- Update ovito requirement from 3.10.6.post2 to 3.11.0.post12 by @dependabot in #155
- Bump sphinx-autoapi from 3.3.2 to 3.3.3 by @dependabot in #154
- Update rdkit requirement from 2024.3.5 to 2024.3.6 by @dependabot in #159
- Bump sphinx-autoapi from 3.3.3 to 3.4.0 by @dependabot in #160
- Update ovito requirement from 3.11.0.post12 to 3.11.2 by @dependabot in #163
- Bump sphinx-rtd-theme from 2.0.0 to 3.0.2 by @dependabot in #161
- Update bpy requirement from 4.2.0 to 4.3.0 by @dependabot in #166
- Update rdkit requirement from 2024.3.6 to 2024.9.1 by @dependabot in #165
- Update pytest requirement from 8.3.3 to 8.3.4 by @dependabot in #164
Full Changelog: v0.3.0...v0.3.8