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Software . 2024
License: CC BY
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License: CC BY
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grimme-lab/mctc-lib: MCTC library version 0.3.2

Authors: Sebastian Ehlert; Eisuke Kawashima; Marcel Stahn; Bugfixe; Andy May; Kjell Jorner; Lori A. Burns; +3 Authors

grimme-lab/mctc-lib: MCTC library version 0.3.2

Abstract

What's Changed Specify executable name for mctc-convert in manifest by @awvwgk in https://github.com/grimme-lab/mctc-lib/pull/53 Fix typos and markdown syntax by @e-kwsm in https://github.com/grimme-lab/mctc-lib/pull/54 Remove compiler ID from include directrory by @yurivict in https://github.com/grimme-lab/mctc-lib/pull/55 Added support for Maestro .mol files. by @MtoLStoN in https://github.com/grimme-lab/mctc-lib/pull/56 fix token positions by @Albkat in https://github.com/grimme-lab/mctc-lib/pull/59 Allows writing of Turbomole format with angstrom. by @MtoLStoN in https://github.com/grimme-lab/mctc-lib/pull/62 Update CI workflow to latest state as of multicharge by @marcelmbn in https://github.com/grimme-lab/mctc-lib/pull/66 Add OpenMP option for CMake by @awvwgk in https://github.com/grimme-lab/mctc-lib/pull/65 Add fix for reading poscar reading by @awvwgk in https://github.com/grimme-lab/mctc-lib/pull/64 Add options if nvfortran is detected by @awvwgk in https://github.com/grimme-lab/mctc-lib/pull/68 Update to version 0.3.2 by @awvwgk in https://github.com/grimme-lab/mctc-lib/pull/69 New Contributors @yurivict made their first contribution in https://github.com/grimme-lab/mctc-lib/pull/55 @MtoLStoN made their first contribution in https://github.com/grimme-lab/mctc-lib/pull/56 @Albkat made their first contribution in https://github.com/grimme-lab/mctc-lib/pull/59 @marcelmbn made their first contribution in https://github.com/grimme-lab/mctc-lib/pull/66 Full Changelog: https://github.com/grimme-lab/mctc-lib/compare/v0.3.1...v0.3.2

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
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Average