setup.json

{
    "name": "aiida-phonoxpy",
    "version": "0.8.1",
    "description": "AiiDA plugin for running phonon calculations using phonopy",
    "url": "https://github.com/atztogo/aiida-phonoxpy",
    "author": "AiiDA-phonoxpy team",
    "author_email": "atz.togo@gmail.com",
    "python_requires": ">=3.8",
    "classifiers": [
        "Intended Audience :: Science/Research",
        "License :: OSI Approved :: MIT License",
        "Programming Language :: Python :: 3.8",
        "Programming Language :: Python :: 3.9",
        "Programming Language :: Python :: 3.10",
        "Topic :: Scientific/Engineering :: Physics",
        "Topic :: Scientific/Engineering :: Chemistry",
        "Development Status :: 5 - Production/Stable",
        "Framework :: AiiDA"
    ],
    "license": "MIT license",
    "install_requires": [
        "phonopy>=2.17.0",
        "numpy",
        "seekpath",
        "aiida-core>=1.6.5,<3.0.0"
    ],
    "extras_require": {
        "tests": [
            "pgtest~=1.3,>=1.3.1",
            "pytest~=6.2",
            "pytest-regressions~=2.2",
            "pandas"
        ]
    },
    "entry_points": {
        "aiida.calculations": [
            "phonoxpy.phonopy = aiida_phonoxpy.calculations.phonopy: PhonopyCalculation",
            "phonoxpy.phono3py = aiida_phonoxpy.calculations.phono3py: Phono3pyCalculation"
        ],
        "aiida.parsers": [
            "phonoxpy.phonopy = aiida_phonoxpy.parsers.phonopy: PhonopyParser",
            "phonoxpy.phono3py = aiida_phonoxpy.parsers.phono3py: Phono3pyParser"
        ],
        "aiida.workflows": [
            "phonoxpy.phonopy = aiida_phonoxpy.workflows.phonopy: PhonopyWorkChain",
            "phonoxpy.phono3py = aiida_phonoxpy.workflows.phono3py: Phono3pyWorkChain",
            "phonoxpy.iter_ha = aiida_phonoxpy.workflows.iter_ha: IterHarmonicApprox",
            "phonoxpy.forces = aiida_phonoxpy.workflows.forces: ForcesWorkChain",
            "phonoxpy.nac_params = aiida_phonoxpy.workflows.nac_params: NacParamsWorkChain",
            "phonoxpy.phono3py_fc = aiida_phonoxpy.workflows.phono3py_fc: Phono3pyFCWorkChain",
            "phonoxpy.phono3py_ltc = aiida_phonoxpy.workflows.phono3py_ltc: Phono3pyLTCWorkChain"
        ]
    }
}