Published August 15, 2023
| Version v1.0.0b4
Software
Open
nanotech-empa/aiida-nanotech-empa: v1.0.0b4
Description
What's Changed
- [pre-commit.ci] pre-commit autoupdate by @pre-commit-ci in https://github.com/nanotech-empa/aiida-nanotech-empa/pull/138
- Unify magnetisation input. by @yakutovicha in https://github.com/nanotech-empa/aiida-nanotech-empa/pull/136
- bug in cv dist: with POINTS also ATOMS is needed by @cpignedoli in https://github.com/nanotech-empa/aiida-nanotech-empa/pull/137
- Remove filename for restart wfn in the low_accuracy and debug protocols by @cpignedoli in https://github.com/nanotech-empa/aiida-nanotech-empa/pull/135
- PDOS work chain: handle the case when multiplicities are not provided. by @yakutovicha in https://github.com/nanotech-empa/aiida-nanotech-empa/pull/140
Full Changelog: https://github.com/nanotech-empa/aiida-nanotech-empa/compare/v1.0.0b3...v1.0.0b4
Files
nanotech-empa/aiida-nanotech-empa-v1.0.0b4.zip
Files
(642.2 kB)
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md5:fc9d54ef370b9ff0edc908027af163e2
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Additional details
Related works
- Is supplement to
- https://github.com/nanotech-empa/aiida-nanotech-empa/tree/v1.0.0b4 (URL)