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PWSCFOutputToPOSCAR
PWSCFOutputToPOSCAR PublicPython script (command line executable) to take Quantum ESPRESSO pw.x vc-relax output (example: Si.Fd-3m.vc-relax.out) and generate VASP POSCAR file named [element].[symmetry group].POSCAR.VASP in …
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pythonmapreduce
pythonmapreduce PublicPython implementation of the WordCount MapReduce concept using books sourced from https://www.gutenberg.org/
Python
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