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Woochang Kim's Projects

bandunfold_kandq icon bandunfold_kandq

Unfold and map bands and k-points from a superlattice BZ to a unit-cell BZ. Also unfolds a subset of Q=0 excitations in the superlattice BZ to the involved finite-Q excitations in the unit-cell BZ.

chi-folding icon chi-folding

Folding polarizability matrix from unit-cell representation to supercell representation

dielectrickit icon dielectrickit

High-performance Fortran program to calculate polarizability and inverse dielectric response function.

hpc icon hpc

A collection of various resources, examples, and executables for the general NREL HPC user community's benefit. Use the following website for accessing documentation.

oncvpseudopack icon oncvpseudopack

Collection of ONCVPSP pseudopotentials for density-functional theory calculations

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