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Ab initio molecular dynamics: Basic concepts, current trends and novel applications
Mark E. Tuckerman
Chemistry
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Material Science
Electronic Structure
100%
Density
100%
Electronic Structure Calculation
100%
Chemistry
Molecular Dynamics
100%
Electronic State
50%
Condensed Phase
25%
Excited State
25%
Born-Oppenheimer Approximation
25%
Lagrangian
25%
Finite-Temperature
25%
Liquid Structure
25%
Engineering
Functional Representation
100%
Liquid Structure
100%
Physics
Molecular Dynamics
100%
Electronic Structure
50%
Excitation
25%
Finite-Temperature
25%
Keyphrases
Structure Basis
33%
Functional Representation
33%
Scale Issues
33%
Growth Technology
33%
Lagrangian Algorithm
33%
Earth and Planetary Sciences
Electronic Structure
100%
State of the Art
50%