Merge requests · FHI Theory / kmos3

Rework and update documentation

!288 · created Sep 20, 2024 by Martin Deimel develop
- Merged
updated Sep 20, 2024
Time acceleration with otf backend and otf bug fixes

!287 · created Sep 20, 2024 by Martin Deimel develop
- Merged
updated Sep 20, 2024
BREAK Initial release of kmos3

!286 · created Mar 12, 2024 by Martin Deimel develop
- Merged
updated Mar 12, 2024
*.ini fix

!273 · created Feb 23, 2023 by Martin Deimel docs
- Merged
- 1
updated Jan 08, 2024
Adding connected_variables feature

!249 · created Dec 05, 2022 by Martin Deimel develop
- Merged
- 2
updated Jan 08, 2024
Minor bugfixes

!280 · created Apr 12, 2023 by Martin Deimel develop
- Merged
- 2
updated Jan 08, 2024
Docs

!259 · created Feb 08, 2023 by Martin Deimel docs
- Merged
- 2
updated Jan 08, 2024
get_next_kmc_step improvement

!240 · created Nov 15, 2022 by Martin Deimel master
- Merged
- 2
updated Jan 08, 2024
Examples

!144 · created Feb 03, 2022 by Martin Deimel develop
- Merged
- 11
updated Jan 08, 2024
otf changes

!154 · created Feb 16, 2022 by Martin Deimel develop
- Merged
- 2
updated Jan 08, 2024
Unit tests update

!150 · created Feb 15, 2022 by Martin Deimel develop
- Merged
- 3
updated Jan 08, 2024
Janaf data / janaf_data

!134 · created Jan 28, 2022 by Martin Deimel develop
- Merged
- 2
updated Jan 08, 2024
Adding linear scaling by thermochemistry feature and unit test

!88 · created Jan 12, 2021 by Martin Deimel master
- Merged
- 2
updated Jan 08, 2024
update version number

!67 · created Dec 14, 2020 by Martin Deimel master
- Merged
- 2
updated Jan 08, 2024
Develop

!58 · created Dec 14, 2020 by Martin Deimel develop-branch-to-in-otf-correction-update
- Merged
- 1
updated Jan 08, 2024
Bringing otf correction to newest develop branch

!55 · created Dec 11, 2020 by Martin Deimel develop-branch-to-in-otf-correction-update
- Merged
- 4
updated Jan 08, 2024
Otf files correction

!54 · created Dec 11, 2020 by Martin Deimel otf-files-correction
- Merged
- 1
updated Jan 08, 2024
docs and unit tests improvements

!57 · created Dec 14, 2020 by Martin Deimel master
- Merged
- 2
updated Jan 08, 2024
Merge in old develop including rate constant rescaling

!34 · created Dec 03, 2020 by Martin Deimel develop
- Merged
- 2
updated Jan 08, 2024
otf backend fix

!68 · created Dec 18, 2020 by Martin Deimel develop
- Merged
- 5
updated Jan 08, 2024