# IT4Innovations
# LK 2023

easyblock = 'CMakeMake'

name = 'tblite'
version = '0.3.0'

homepage = 'http://www.example.com'
description = """This project is an effort to create a library implementation of the extended tight binding (xTB) Hamiltonian which can be shared between xtb and dftb+. The current state of this project should be considered as highly experimental."""

toolchain = {'name': 'intel', 'version': '2022b'}

import os
if os.environ.get("CLUSTERNAME") in ["KAROLINA"]:
    toolchainopts = {'optarch': 'march=core-avx2'}

source_urls = ['https://github.com/tblite/tblite/archive/refs/tags/']
sources = ['v%(version)s.tar.gz']
checksums = ['44b6ecff94b29c109f7d1afa3f49eebd3979a2b115fc7bab0c9fc1d7e61bdc27']

builddependencies = [
    ('CMake', '3.24.3'),
]

moduleclass = 'lib'
