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new file: d/DynaPhoPy/DynaPhoPy-1.15-intel-2017a-Python-2.7.13-base.eb new file: d/DynaPhoPy/DynaPhoPy-1.16.3-Py-3.6.eb modified: g/GLib/GLib-2.40.0.eb new file: l/lxml/lxml-4.1.1-Py-3.6.eb new file: p/phonopy/phonopy-1.12.6.66-Py-3.6.eb modified: q/Qt5/Qt5-5.8.0-GCC-6.3.0-2.27.eb new file: s/seaborn/graph-salomon.dot new file: s/seaborn/seaborn-0.8.1-Py-3.6.eb modified: x/X11/X11-20160819.eb deleted: d/DynaPhoPy/DynaPhoPy-1.15.eb
26 lines
541 B
Plaintext
26 lines
541 B
Plaintext
# IT4Innovations 2018
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easyblock = 'PythonPackage'
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name = 'phonopy'
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version = '1.12.6.66'
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homepage = 'https://atztogo.github.io/phonopy'
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description = """Phonopy is an open source package of phonon calculations based on the supercell approach."""
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toolchain = {'name': 'Py', 'version': '3.6'}
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source_urls = [PYPI_SOURCE]
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sources = [SOURCE_TAR_GZ]
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dependencies = [
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('matplotlib', '2.1.1'),
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('lxml', '4.1.1'),
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('PyYAML', '3.12'),
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('numpy', '1.13.3'),
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('h5py', '2.7.1'),
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('scipy', '1.0.0')
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]
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moduleclass = 'python'
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