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[pull] master from crest-lab:master - #65

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pull[bot] merged 3 commits into
grimme-lab:masterfrom
crest-lab:master
Nov 24, 2025
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[pull] master from crest-lab:master#65
pull[bot] merged 3 commits into
grimme-lab:masterfrom
crest-lab:master

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Created by pull[bot] (v2.0.0-alpha.4)

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chertianser and others added 3 commits November 24, 2025 15:12
A small refactor of the GitHub workflows plus:
-  adding alias for `--cinp`: `-C`/`-c`
- position independent input file readout from cli
- Update of the `tblite` submodule to its version 0.5.0
- activation of pre-optimization when selecting search runtypes via toml
- `-grad`/`-nograd` flags for `--sp` runtype.
@pull pull Bot locked and limited conversation to collaborators Nov 24, 2025
@pull pull Bot added the ⤵️ pull label Nov 24, 2025
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pull Bot merged commit 3f19b05 into grimme-lab:master Nov 24, 2025
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2 participants