Releases: osscar-org/quantum-mechanics
Releases · osscar-org/quantum-mechanics
v2024.06.05
Updates and changes:
- update widgets with anywidget technology
- upgrade to Voila 0.5.x
- fix bugs and issues for all notebooks
What's Changed
- Update pip requirement from ~=22.2.2 to ~=22.3 by @dependabot in #165
- Update pandas requirement from ~=1.5.0 to ~=1.5.1 by @dependabot in #166
- Update scipy requirement from ~=1.9.2 to ~=1.9.3 by @dependabot in #169
- Update plotly requirement from ~=5.10.0 to ~=5.11.0 by @dependabot in #173
- Update ipython requirement from ~=8.5.0 to ~=8.6.0 by @dependabot in #177
- Update matplotlib requirement from ~=3.6.1 to ~=3.6.2 by @dependabot in #179
- Finalized BZ notebook. by @Taylor-96 in #180
- Phonons 1d by @dou-du in #182
- Update numpy requirement from ~=1.23.4 to ~=1.23.5 by @dependabot in #184
- Update pandas requirement from ~=1.5.1 to ~=1.5.2 by @dependabot in #186
- One quantum well by @dou-du in #187
- update two quantum wells notebooks by @dou-du in #188
- Update ipython requirement from ~=8.6.0 to ~=8.7.0 by @dependabot in #192
- Diffusion 2d by @Taylor-96 in #197
- implement Giovanni's improvement for the diffusion 2D by @dou-du in #212
- Update ipython requirement from ~=8.7.0 to ~=8.9.0 by @dependabot in #211
- Update cython requirement from ~=0.29.32 to ~=0.29.33 by @dependabot in #205
- Update scipy requirement from ~=1.9.3 to ~=1.10.0 by @dependabot in #202
- Update numpy requirement from ~=1.23.5 to ~=1.24.1 by @dependabot in #199
- Update plotly requirement from ~=5.11.0 to ~=5.13.0 by @dependabot in #217
- Update pip requirement from ~=22.3 to ~=23.0 by @dependabot in #216
- Update pandas requirement from ~=1.5.2 to ~=1.5.3 by @dependabot in #215
- Update matplotlib requirement from ~=3.6.2 to ~=3.6.3 by @dependabot in #214
- Final review of the double square quantum wells by @dou-du in #222
- Update numpy requirement from ~=1.24.1 to ~=1.24.2 by @dependabot in #221
- Update of Asymmetric Well App by @dou-du in #223
- Update ipython requirement from ~=8.9.0 to ~=8.10.0 by @dependabot in #225
- fix the mu in the solutions by @dou-du in #226
- Update scipy requirement from ~=1.10.0 to ~=1.10.1 by @dependabot in #233
- Update plotly requirement from ~=5.13.0 to ~=5.13.1 by @dependabot in #235
- Update ipython requirement from ~=8.10.0 to ~=8.11.0 by @dependabot in #238
- update the test by clicking the matplotlib download button by @dou-du in #229
- Update ipython requirement from ~=8.11.0 to ~=8.12.0 by @dependabot in #244
- Update plotly requirement from ~=5.13.1 to ~=5.14.0 by @dependabot in #243
- Update pandas requirement from ~=1.5.3 to ~=2.0.1 by @dependabot in #255
- Update plotly requirement from ~=5.14.0 to ~=5.14.1 by @dependabot in #251
- Update cython requirement from ~=0.29.33 to ~=0.29.34 by @dependabot in #247
- Update numpy requirement from ~=1.24.2 to ~=1.24.3 by @dependabot in #260
- Update ipython requirement from ~=8.12.0 to ~=8.13.1 by @dependabot in #261
- Update nglview requirement from ~=3.0.3 to ~=3.0.4 by @dependabot in #259
- Update ipython requirement from ~=8.13.1 to ~=8.13.2 by @dependabot in #263
- Update pip requirement from ~=23.0 to ~=23.1 by @dependabot in #258
- add development section by @dou-du in #264
- Modifications to the text of Verlet nb. Added author list. by @Taylor-96 in #265
- Update sympy requirement from ~=1.11.1 to ~=1.12 by @dependabot in #266
- Shooting method by @Taylor-96 in #270
- Soft review by @Taylor-96 in #268
- Update cython requirement from ~=0.29.34 to ~=0.29.36 by @dependabot in #275
- Update pandas requirement from ~=2.0.1 to ~=2.0.3 by @dependabot in #274
- Update seekpath requirement from ~=2.0.1 to ~=2.1.0 by @dependabot in #269
- Update plotly requirement from ~=5.14.1 to ~=5.15.0 by @dependabot in #278
- Update numpy requirement from ~=1.24.3 to ~=1.25.1 by @dependabot in #277
- Update pip requirement from ~=23.1 to ~=23.2 by @dependabot in #281
- Update cython requirement from ~=0.29.36 to ~=3.0.0 by @dependabot in #282
- Update nglview requirement from ~=3.0.4 to ~=3.0.6 by @dependabot in #280
- Update scipy requirement from ~=1.10.1 to ~=1.11.1 by @dependabot in #286
- Update ipython requirement from ~=8.13.2 to ~=8.14.0 by @dependabot in #283
- Update numpy requirement from ~=1.25.1 to ~=1.25.2 by @dependabot in #288
- Update plotly requirement from ~=5.15.0 to ~=5.16.1 by @dependabot in #287
- Update scipy requirement from ~=1.11.1 to ~=1.11.2 by @dependabot in #291
- Update cython requirement from ~=3.0.0 to ~=3.0.2 by @dependabot in #293
- Update ipyevents requirement from ~=2.0.1 to ~=2.0.2 by @dependabot in #290
- Update pandas requirement from ~=2.0.3 to ~=2.1.0 by @dependabot in #295
- Update nglview requirement from ~=3.0.6 to ~=3.0.7 by @dependabot in #294
- Update ipython requirement from ~=8.14.0 to ~=8.15.0 by @dependabot in #296
- Update nglview requirement from ~=3.0.7 to ~=3.0.8 by @dependabot in #299
- Update plotly requirement from ~=5.16.1 to ~=5.17.0 by @dependabot in #303
- Update numpy requirement from ~=1.25.2 to ~=1.26.0 by @dependabot in #302
- Update pandas requirement from ~=2.1.0 to ~=2.1.1 by @dependabot in #305
- Msoft review by @Taylor-96 in #309
- Revert "Msoft review" by @Taylor-96 in #310
- Changed default number of trials to 100. by @Taylor-96 in #312
- Anywidgets and update deps by @eimrek in #322
- Update README.md by @dou-du in #339
- Update matplotlib requirement from ~=3.8.4 to ~=3.9.0 by @dependabot in #338
- Update pandas requirement from ~=2.2.1 to ~=2.2.2 by @dependabot in #334
- Update plotly requirement from ~=5.20.0 to ~=5.22.0 by @dependabot in #336
- Update widget-bzvisualizer requirement from ~=0.2.4 to ~=0.2.7 by @dependabot in #337
- Update widget-bandsplot requirement from ~=0.7.0 to ~=0.7.3 by @dependabot in #335
- Update ipympl requirement from ~=0.9.3 to ~=0.9.4 by @dependabot in https://github.com/ossc...
v2022.10.17
Updates and changes:
- Fix the problem with new version of matplotlib (interaction figures are not responsing to the widgets)
- Update the workflows
v2022.09.06
Updates and changes:
- Fix the issue, which the matplotlib figures are not responding to the ipywidgets.
v2022.08.09
Updates and changes:
- Add new section "Molecule and Lattice Vibration"
- Phonon 1D
- Phonon 2D
- Molecule Vibration
v2021.05.10
- Rename it to "Quantum Mechanics and Computational Materials Science".
- Divide the topics into sections.
- Add the shooting method and pseudopotential notebooks.