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Physical Review Letters

Volumn 100, Issue 12, 2008, Pages

Extended Born-Oppenheimer molecular dynamics

(1) Niklasson, Anders M N a,b

a LOS ALAMOS NATIONAL LABORATORY (United States)

b ROYAL INSTITUTE OF TECHNOLOGY (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; CONVERGENCE OF NUMERICAL METHODS; DEGREES OF FREEDOM (MECHANICS); ENERGY CONSERVATION; GEOMETRY;

ADIABATIC PROPAGATION; DYNAMICAL VARIABLES; GEOMETRIC INTEGRATION;

MOLECULAR DYNAMICS;

EID: 41549099103 PISSN: 00319007 EISSN: 10797114 Source Type: Journal
DOI: 10.1103/PhysRevLett.100.123004 Document Type: Article

Times cited : (159)

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