Artículo
Comment on “Markovian approximation in a coarse-grained description of atomic systems” [J. Chem. Phys.125, 204101 (2006)]
Autor/es | Cubero Gómez, David |
Departamento | Universidad de Sevilla. Departamento de Física Aplicada I |
Fecha de publicación | 2008 |
Fecha de depósito | 2015-05-29 |
Publicado en |
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Resumen | The authors concluded that the coarse-graining dynamics of a one-dimensional chain of oscillators interacting through Lennard–Jones potentials is Markovian, in contrast with the situation observed for harmonic lattices. ... The authors concluded that the coarse-graining dynamics of a one-dimensional chain of oscillators interacting through Lennard–Jones potentials is Markovian, in contrast with the situation observed for harmonic lattices. However, with the help of a novel equation that relates the correlation of forces and momenta, I show that this conclusion is drawn from an incorrect analysis of the simulation data. |
Agencias financiadoras | Ministerio de Educación y Ciencia (MEC). España |
Ficheros | Tamaño | Formato | Ver | Descripción |
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JCP_Cubero_2008_comment.pdf | 397.0Kb | [PDF] | Ver/ | |