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nomad-coe / nomad-simulations
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Repo Added 04 Jun 2024 10:07AM UTC
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03 Dec 2024 04:29PM UTC coverage: 0.0% (-80.1%) from 80.147%
12144007686

Pull #148

github

Bernadette-Mohr
marked issues from calls to ase functions
Pull Request #148: Cg particle support

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Recent builds

Builds Branch Commit Type Ran Committer Via Coverage
12144007686 cg-particle-support marked issues from calls to ase functions Pull #148 03 Dec 2024 04:30PM UTC Bernadette-Mohr github
0.0
12053175204 cg-particle-support Make chemical formula generation and normalization of atom types conditional Pull #148 27 Nov 2024 03:14PM UTC Bernadette-Mohr github
0.0
11973025791 cg-particle-support Cell is 'ParticleCell', normalizer still calls atomic_cell.to_ase_atoms push 22 Nov 2024 12:58PM UTC Bernadette-Mohr github
0.0
11800422194 cg-particle-support Fixed wrong shape of bond_list in model_system push 12 Nov 2024 03:28PM UTC Bernadette-Mohr github
0.0
11370330786 cg-particle-support Converted lattice vectors to Nomad-compatible matrix format. push 16 Oct 2024 05:00PM UTC Bernadette Mohr github
0.0
11330921152 cg-particle-support working on CG schema push 14 Oct 2024 03:48PM UTC Bernadette Mohr github
0.0
11293254581 cg-particle-support working on CG schema push 11 Oct 2024 01:29PM UTC Bernadette Mohr github
0.0
11232133781 cg-particle-support Adding support for coarse-grained models push 08 Oct 2024 09:04AM UTC Bernadette Mohr github
58.26
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