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e03effe24f
new file: a/ANSYS/ANSYS-2023R1-intel-2022a-vut.eb new file: c/cuQuantum/cuQuantum-23.10.0.6_cuda12-conda.eb new file: g/GPAW/GPAW-23.9.1-intel-2022a.eb
29 lines
566 B
Plaintext
29 lines
566 B
Plaintext
# IT4Innovations
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# LK 2023
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easyblock = "Conda"
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name = 'cuQuantum'
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version = '23.10.0'
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versionsuffix = '-CUDA-12.2.0-conda'
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homepage = 'http://phonopy.sourceforge.net/phono3py/index.html'
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description = """This software calculates phonon-phonon interaction related properties"""
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toolchain = SYSTEM
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dependencies = [
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('Anaconda3', '2023.07-2'),
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('CUDA', '12.2.0', '', True),
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]
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requirements = "cuquantum cuda-version=12 cuquantum-python"
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channels = ['conda-forge']
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sanity_check_paths = {
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'files': [],
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'dirs': ['bin', 'lib']
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}
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moduleclass = 'phys'
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