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Bonan Zhu's Projects

phono3py icon phono3py

A simulation package of phonon-phonon interaction related properties

pymatgen icon pymatgen

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.

res2desc icon res2desc

Computing descriptors for AIRSS style SHELX files.

smact icon smact

Python package to aid materials design

sumo icon sumo

Heavyweight plotting tools for ab initio calculations

temporal.jl icon temporal.jl

Time series implementation for the Julia language focused on efficiency and flexibility

tm4 icon tm4

Transition matrix optical simulations using Berreman and Yeh's methodology

transformer icon transformer

A Python library for transforming structures by performing atomic substitutions.

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