Prediction of self‐diffusion coefficients of chemically diverse pure liquids by all‐atom molecular dynamics simulations-Reference-Cited by-同舟云学术

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Prediction of self‐diffusion coefficients of chemically diverse pure liquids by all‐atom molecular dynamics simulations

Published:2022-08-09 Issue:28 Volume:43 Page:1892-1900
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Baba Hiromi¹²^ORCID,Urano Ryo³,Nagai Tetsuro²⁴,Okazaki Susumu²

Affiliation:

1. New Modality Research Group, Research Department Kyoto R&D Center, Maruho Co., Ltd. Kyoto Japan

2. Department of Advanced Materials Science The University of Tokyo Chiba Japan

3. Research Institute for Interdisciplinary Science Okayama University Okayama Japan

4. Department of Chemistry, Faculty of Science Fukuoka University Nanakuma Japan

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26975

Reference77 articles.

1. Computer Simulation of Liquids

2. Physicochemical and Structural Properties of a Hydrophobicity/Hydrophilicity Switchable Ionic Liquid

3. Viscosity of Lennard-Jones mixtures: A systematic study and empirical law

4. Structure and Mass Transport Characteristics at the Intrinsic Liquid–Vapor Interfaces of Alkanes

5. Self-diffusion and structural properties of confined fluids in dynamic coexistence

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