Beast code in Giters

Eric Bylaska's repositories

Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software

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TinyArrows is a tiny version of EMSL Arrows

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Software for generating SNAP machine-learning interatomic potentials

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NWChem: Open Source High-Performance Computational Chemistry

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Repolsitory for NWChem nanohub developments

Config files for my GitHub profile.

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hybrid openmp-mpi kernels for the nwpw module in nwchem

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Machine learning potential work with Raymond

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NWChem Documentation

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A repository for Docker, Singularity and Shifter Files

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Simple CPSD code

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