A single-GPU implementation of first-principles molecular dynamics.

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Bibliographic Details
Title: A single-GPU implementation of first-principles molecular dynamics.
Authors: Gygi, François1 fgygi@ucdavis.edu
Source: Journal of Chemical Physics. 10/21/2025, Vol. 163 Issue 15, p1-7. 7p.
Database: Academic Search Ultimate
Description
ISSN:00219606
DOI:10.1063/5.0288397