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########################################################################## # # name: kpoints-bz-vasp.py # author: Keith Butler # ########################################################################## A script for generating explicit KPOINTS for Brillouin zone sampling. Requires as input a POSCAR file. Then asks for the crystal lattice type and the points to be samped and the number of sample points to use. ########################################################################## Execution: python kpoints-bz-vasp.py Requirements: ase, numpy ##########################################################################
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Generate kpoins for sampling Brillouin zones
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