Measure-preserving integrators for molecular dynamics in the isothermal–isobaric ensemble derived from the Liouville operator
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference44 articles.
1. Canonical dynamics: Equilibrium phase-space distributions
2. The Nosé–Poincaré Method for Constant Temperature Molecular Dynamics
3. Nosé–Hoover chains: The canonical ensemble via continuous dynamics
4. Explicit reversible integrators for extended systems dynamics
5. Molecular dynamics simulations at constant pressure and/or temperature
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