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new file: p/phono3py/phono3py-1.19.1-conda.eb new file: p/phono3py/phono3py-1.19.1-intel-2020a-Py-3.7
28 lines
535 B
Plaintext
28 lines
535 B
Plaintext
# IT4Innovations 2020
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# LK
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easyblock = "Conda"
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name = 'phono3py'
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version = '1.19.1'
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versionsuffix = '-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', '2019.10'),
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]
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requirements = "%(namelower)s=%(version)s python=3.7"
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channels = ['atztogo']
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sanity_check_paths = {
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'files': ['bin/phono3py', 'bin/phonopy'],
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'dirs': ['bin', 'lib']
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}
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moduleclass = 'phys'
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