.gitattributes
.gitignore
.pre-commit-config.yaml
LICENSE
README.md
config
pyproject.toml
requirements-dev.txt
requirements.txt
run-tests.sh
setup.cfg
./exaparser/__init__.py
./exaparser/_version.py
./exaparser/cli.py
./exaparser/config.py
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./exaparser/utils.py
./exaparser/data/__init__.py
./exaparser/data/factory.py
./exaparser/data/handlers/__init__.py
./exaparser/data/handlers/disk.py
./exaparser/data/handlers/exabyte.py
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./exaparser/job/__init__.py
./exaparser/job/compute/__init__.py
./exaparser/job/compute/factory.py
./exaparser/job/compute/managers/__init__.py
./exaparser/job/compute/managers/pbs.py
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./exaparser/workflow/units/execution/scripting/shell_with_results.py
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exaparser/__init__.py
exaparser/cli.py
exaparser/config.py
exaparser/enums.py
exaparser/utils.py
exaparser.egg-info/PKG-INFO
exaparser.egg-info/SOURCES.txt
exaparser.egg-info/dependency_links.txt
exaparser.egg-info/entry_points.txt
exaparser.egg-info/requires.txt
exaparser.egg-info/top_level.txt
exaparser/data/__init__.py
exaparser/data/factory.py
exaparser/data/handlers/__init__.py
exaparser/data/handlers/disk.py
exaparser/data/handlers/exabyte.py
exaparser/data/handlers/stdout.py
exaparser/job/__init__.py
exaparser/job/compute/__init__.py
exaparser/job/compute/factory.py
exaparser/job/compute/managers/__init__.py
exaparser/job/compute/managers/pbs.py
exaparser/job/compute/managers/slurm.py
exaparser/templates/espresso.json
exaparser/templates/shell.json
exaparser/templates/vasp.json
exaparser/workflow/__init__.py
exaparser/workflow/subworkflow.py
exaparser/workflow/workflow.py
exaparser/workflow/units/__init__.py
exaparser/workflow/units/factory.py
exaparser/workflow/units/subworkflow.py
exaparser/workflow/units/execution/__init__.py
exaparser/workflow/units/execution/modeling/__init__.py
exaparser/workflow/units/execution/modeling/espresso.py
exaparser/workflow/units/execution/modeling/vasp.py
exaparser/workflow/units/execution/scripting/__init__.py
exaparser/workflow/units/execution/scripting/shell.py
exaparser/workflow/units/execution/scripting/shell_with_results.py
tests/__init__.py
tests/enums.py
tests/utils.py
tests/fixtures/espresso/shell-job.json
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tests/fixtures/vasp/test-001/DOSCAR
tests/fixtures/vasp/test-001/EIGENVAL
tests/fixtures/vasp/test-001/IBZKPT
tests/fixtures/vasp/test-001/INCAR
tests/fixtures/vasp/test-001/KPOINTS
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tests/fixtures/vasp/test-001/POSCAR
tests/fixtures/vasp/test-001/POTCAR
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