Dynamical Non-Equilibrium Molecular Dynamics
In this review, we discuss the Dynamical approach to Non-Equilibrium Molecular Dynamics (D-NEMD), which extends stationary NEMD to time-dependent situations, be they responses or relaxations. Based on the original Onsager regression hypothesis, implemented in the nineteen-seventies by Ciccotti, Jacu...
Main Authors: | , |
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Format: | Article |
Language: | English |
Published: |
MDPI AG
2013-12-01
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Series: | Entropy |
Subjects: | |
Online Access: | http://www.mdpi.com/1099-4300/16/1/233 |