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Warda Rahim's Projects

convtest icon convtest

A simple code for plane wave cutoff and kmesh convergence test

fromage icon fromage

Framework for Molecular Aggregate Excitation

modemap icon modemap

A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.

modemapplotter icon modemapplotter

A tool for plotting one-dimensional and two-dimensional potential energy surfaces along phonon modes.

phononplotter icon phononplotter

A tool for plotting phonon dispersion curves and phonon density of states.

scripts-compchem icon scripts-compchem

A set of scripts I have written for dealing with computational chemistry data from phonopy, phono3py, boltztrap, etc. packages.

sumo icon sumo

Heavyweight plotting tools for ab initio calculations

thermoplotter icon thermoplotter

A tool for making data analysis and plotting scripts for thermoelectrics codes used in computational materials science.

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