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Add a harness for MACE-OFF23 and local MACE models #687

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Add a harness for MACE-OFF23 and local MACE models

Add a harness for MACE-OFF23 and local MACE models #687

Run time

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Job Run time
🐍 3.7 • Psi4-1.5 • ubuntu-latest
6m 59s
🐍 3.10 • Psi4-1.6 • ubuntu-latest
5m 53s
🐍 3.12 • Psi4-1.8 • windows-latest
10m 36s
🐍 3.8 • ANI • ubuntu-latest
2m 7s
🐍 3.8 • OpenMM • ubuntu-latest
2m 11s
🐍 3.10 • xTB • ubuntu-latest
1m 15s
🐍 3.7 • QCore • ubuntu-latest
1m 48s
🐍 3.8 • NWChem70 • ubuntu-20.04
4m 47s
🐍 3.12 • NWChem • ubuntu-latest
9m 5s
🐍 3.8 • MRChem • ubuntu-latest
10m 50s
🐍 3.8 • ADCC • ubuntu-latest
5m 15s
🐍 3.8 • optimization-dispersion • ubuntu-latest
3m 14s
🐍 3.11 • optimization-dispersion • windows-latest
14m 29s
🐍 3.10 • MACE • ubuntu-latest
1m 42s
🐍 ${{ matrix.cfg.python-version }} • ${{ matrix.cfg.label }}
0s
1h 20m 11s