MaterialsAtlas Software and Tool

QMCPACK

quantum-monte-carloelectronic-structurehpccorrelated-materialscomputational-materials-softwaresoftware-tools

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High-performance quantum Monte Carlo code for accurate electronic structure of atoms, molecules, solids, and correlated materials.

Citation: QMCPACK. Computational materials software/tool. https://www.qmcpack.org/

Acknowledgement: Curated by MaterialsAtlas Open Resources from official project pages, documentation, and common computational materials workflows.

TypeSoftware and Tool

DomainQuantum Monte Carlo

LicenseNCSA

Contributorsqmcpack.org