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Issues
A
src\quacc\calculators\qchem\qchem.py
9 29 -
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src\quacc\calculators\vasp\presets\magmoms_qmof.yaml
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src\quacc\calculators\vasp\__init__.py
 4 -
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src\quacc\calculators\espresso\__init__.py
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src\quacc\calculators\espresso\espresso.py
37 4 -
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.github\ISSUE_TEMPLATE\misc.yaml
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src\quacc\calculators\vasp\presets\DefaultSetHSE06.yaml
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src\quacc\calculators\espresso\presets\__init__.py
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src\quacc\calculators\vasp\presets\DefaultSetMetaGGA.yaml
 2 -
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.github\ISSUE_TEMPLATE\config.yml
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src\quacc\calculators\vasp\presets\QMOFSet.yaml
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src\quacc\calculators\espresso\presets\esm_metal_slab_precision.yaml
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src\quacc\calculators\vasp\presets\SlabSetPBE.yaml
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src\quacc\_cli\__init__.py
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src\quacc\calculators\vasp\presets\setups_qmof.yaml
 4 -
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src\quacc\calculators\vasp\presets\setups_default.yaml
 4 -
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.codecov.yml
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.github\dependabot.yml
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src\quacc\_cli\quacc.py
10 3 -
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src\quacc\calculators\espresso\presets\metal_efficiency.yaml
 3 -