Gaussian Approximation Potentials: The Accuracy of Quantum Mechanics, without the Electrons
Author:
Publisher
American Physical Society (APS)
Subject
General Physics and Astronomy
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevLett.104.136403/fulltext
Reference24 articles.
1. Iterative minimization techniques forab initiototal-energy calculations: molecular dynamics and conjugate gradients
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3. The Art and Science of an Analytic Potential
4. Hybrid atomistic simulation methods for materials systems
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