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Name
Complexity
Churn
Issues
A
src\quacc\calculators\mrcc\io.py
25 1 -
A
src\quacc\calculators\mrcc\mrcc.py
9 2 -
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src\quacc\calculators\qchem\__init__.py
 4 -
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src\quacc\calculators\qchem\io.py
12 17 -
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src\quacc\calculators\qchem\params.py
22 11 -
A
src\quacc\calculators\qchem\qchem.py
9 29 -
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src\quacc\calculators\qchem\qchem_custodian.py
8 2 -
A
src\quacc\calculators\vasp\__init__.py
 4 -
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src\quacc\calculators\vasp\io.py
6 8 -
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src\quacc\calculators\vasp\params.py
93 24 1
A
src\quacc\calculators\vasp\presets\DefaultSetGGA.yaml
 1 -
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src\quacc\calculators\vasp\presets\DefaultSetHSE06.yaml
 1 -
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src\quacc\calculators\vasp\presets\DefaultSetHybrid.yaml
 3 -
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src\quacc\calculators\vasp\presets\DefaultSetMetaGGA.yaml
 2 -
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src\quacc\calculators\vasp\presets\DefaultSetR2SCAN.yaml
 1 -
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src\quacc\calculators\vasp\presets\QMOFSet.yaml
 2 -
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src\quacc\calculators\vasp\presets\RosenSetPBE.yaml
 9 -
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src\quacc\calculators\vasp\presets\SlabSetPBE.yaml
 2 -
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src\quacc\calculators\vasp\presets\__init__.py
 2 -
A
src\quacc\calculators\vasp\presets\magmoms_high.yaml
 1 -