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Issues
A
src\quacc\calculators\vasp\presets\DefaultSetHSE06.yaml
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src\quacc\calculators\vasp\presets\DefaultSetGGA.yaml
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src\quacc\wflow_tools\__init__.py
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tests\core\atoms\test_ts.py
4 1 1
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src\quacc\calculators\mrcc\io.py
25 1 -
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src\quacc\wflow_tools\job_argument.py
4 1 -
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src\quacc\recipes\onetep\__init__.py
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tests\core\recipes\mrcc_recipes\conftest.py
2 1 -
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src\quacc\recipes\dftb\__init__.py
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src\quacc\recipes\mlp\__init__.py
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tests\core\calculators\mrcc\conftest.py
2 1 -
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src\quacc\calculators\vasp\presets\DefaultSetR2SCAN.yaml
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tests\core\calculators\mrcc\test_io.py
9 1 -
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src\quacc\wflow_tools\context.py
8 1 -
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tests\core\calculators\mrcc\test_mrcc.py
2 1 -
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tests\core\utils\test_kpts.py
1 1 -
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tests\core\runners\test_generic.py
0 1 -
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src\quacc\recipes\mrcc\__init__.py
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src\quacc\calculators\vasp\presets\magmoms_high.yaml
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src\quacc\calculators\mrcc\__init__.py
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