pyRMG: A Framework for High-Throughput, Large-Cell DFT Calculations on Supercomputers

Fuente: arXiv
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Bibliographic Details
Main Authors: Morelock, R. J., Bagchi, S., Briggs, E. L., Lu, W., Bernholc, J., Ganesh, P.
Format: Preprint
Published: 2025
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