Extended Gibbs ensembles with flow
A recently proposed statistical treatment of finite unbound systems in the presence of collective motions is applied to a classical Lennard-Jones system, numerically simulated through molecular dynamics. In the ideal gas limit, the flow dynamics can be exactly recast into effective time-dependent La...
Guardado en:
Autores principales: | Ison, Matías Julián, Dorso, Claudio Oscar |
---|---|
Publicado: |
2007
|
Materias: | |
Acceso en línea: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_15393755_v76_n5_p_Ison http://hdl.handle.net/20.500.12110/paper_15393755_v76_n5_p_Ison |
Aporte de: |
Ejemplares similares
-
Extended Gibbs ensembles with flow
por: Ison, M.J., et al. -
Expansion dynamics of Lennard-Jones systems
por: Ison, Matías Julián, et al.
Publicado: (2008) -
QSPR modeling of Gibbs free energy of organic compounds by weighting of nearest neighboring codes
por: Castro, Eduardo Alberto, et al.
Publicado: (2005) -
On the accurate estimation of free energies using the jarzynski equality
Publicado: (2019) -
On the accurate estimation of free energies using the jarzynski equality
por: Arrar, M., et al.