Measure-preserving integrators for molecular dynamics in the isothermal-isobaric ensemble derived from the Liouville operator
- Tang-Qing Yu
- José Alejandre
- et al.
- 2010
- Chemical Physics
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A Liouville-operator derived measure-preserving integrator for molecular dynamics simulations in the isothermal-isobaric ensemble
- Mark E. Tuckerman
- José Alejandre
- et al.
- 2006
- Journal of Physics A: Mathematical and General