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Thermostating extended Lagrangian Born-Oppenheimer molecular dynamics.

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Bibliographic Details
Title: Thermostating extended Lagrangian Born-Oppenheimer molecular dynamics.
Authors: Martínez, Enrique1 enriquem@lanl.gov, Cawkwell, Marc J.2, Voter, Arthur F.2, Niklasson, Anders M. N.2 amn@lanl.gov
Source: Journal of Chemical Physics. 2015, Vol. 142 Issue 15, p1-10. 10p. 5 Charts, 6 Graphs.
Database: Academic Search Ultimate
Description
ISSN:00219606
DOI:10.1063/1.4917546