Quantum Chemistry on Graphical Processing Units. 3. Analytical Energy Gradients, Geometry Optimization, and First Principles Molecular Dynamics
Author:
Affiliation:
1. Department of Chemistry, Stanford University, Stanford, California 94305
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct9003004
Reference26 articles.
1. Real-time robot motion planning using rasterizing computer graphics hardware
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