PyRET/pyproject.toml at main · MICCoMpy/PyRET · GitHub

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[build-system]
requires = ["setuptools>=68", "wheel"]
build-backend = "setuptools.build_meta"

[project]
name = "pyRET"
authors = [
	{ name = "Swarnabha Chattaraj", email = "schattaraj@anl.gov"},
]
description = "First-principles tools for radiative and nonradiative resonant energy transfer between localized defects."
readme = "README.md"
requires-python = ">=3.9"
license = { file = "LICENSE" }
dependencies = [
	"numpy",
	"scipy",
	"h5py",
	"matplotlib",
	"mpi4py",
	"pyscf",
    "sphinx",
    "sphinx_rtd_theme",
]
version = "0.0"


[project.scripts]
pyRET_compute_matrix_elements = "pyRET.run:main"
pyRET_load_wavefunctions_qe = "pyRET.loadWF_QE:main"
pyRET_load_wavefunctions_atomic = "pyRET.loadWF_Atomic:main"

[tool.setuptools]
include-package-data = true

[tool.setuptools.packages.find]
where = ["."]
include = ["pyRET*"]