Reliable Viscosity Calculation from Equilibrium Molecular Dynamics Simulations: A Time Decomposition Method-Reference-Cited by-同舟云学术

Reliable Viscosity Calculation from Equilibrium Molecular Dynamics Simulations: A Time Decomposition Method

Published:2015-07-23 Issue:8 Volume:11 Page:3537-3546
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Zhang Yong¹,Otani Akihito¹,Maginn Edward J.¹

Affiliation:

1. Department of Chemical and Biomolecular Engineering and the Joint Center for Energy Storage Research, University of Notre Dame, Notre Dame, Indiana 46556, United States

Funder

Basic Energy Sciences

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00351

Reference58 articles.

1. Nonlinear-response theory for steady planar Couette flow

2. Nonequilibrium molecular dynamics approaches to transport properties and non-Newtonian fluid rheology

3. Reversing the perturbation in nonequilibrium molecular dynamics: An easy way to calculate the shear viscosity of fluids

4. Efficient viscosity estimation from molecular dynamics simulation via momentum impulse relaxation

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