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Issues
A
tests\core\recipes\orca_recipes\test_orca_recipes.py
9 5 -
A
src\quacc\recipes\mrcc\__init__.py
 1 -
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tests\core\recipes\qchem_recipes\jenkins\test_core_recipes.py
2 2 -
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src\quacc\calculators\espresso\__init__.py
 4 -
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tests\core\recipes\tblite_recipes\test_tblite_phonons.py
1 10 -
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src\quacc\recipes\mrcc\core.py
0 2 -
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tests\core\recipes\torchsim_recipes\test_torchsim_recipes.py
3 2 -
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.github\workflows\tests.yaml
 38 -
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tests\core\recipes\vasp_recipes\mocked\conftest.py
8 3 -
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src\quacc\recipes\newtonnet\core.py
1 3 -
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tests\core\runners\test_ase.py
6 5 -
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src\quacc\calculators\vasp\presets\DefaultSetHSE06.yaml
 1 -
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tests\core\utils\test_lists.py
1 2 -
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tests\core\utils\test_kpts.py
1 1 -
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tests\core\runners\test_sella.py
2 6 -
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.github\ISSUE_TEMPLATE\config.yml
 3 -
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.github\dependabot.yml
 3 -
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src\quacc\__init__.py
4 3 -
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src\quacc\calculators\espresso\presets\esm_semiconductors_slab_efficiency.yaml
 3 -
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src\quacc\recipes\torchsim\core.py
0 2 -