OCTP: A Tool for On-the-Fly Calculation of Transport Properties of Fluids with the Order-n Algorithm in LAMMPS-Reference-Cited by-同舟云学术

OCTP: A Tool for On-the-Fly Calculation of Transport Properties of Fluids with the Order-n Algorithm in LAMMPS

Published:2019-02-11 Issue:4 Volume:59 Page:1290-1294
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Jamali Seyed Hossein¹^ORCID,Wolff Ludger²^ORCID,Becker Tim M.¹^ORCID,de Groen Mariëtte¹,Ramdin Mahinder¹^ORCID,Hartkamp Remco¹^ORCID,Bardow André²^ORCID,Vlugt Thijs J. H.¹^ORCID,Moultos Othonas A.¹^ORCID

Affiliation:

1. Engineering Thermodynamics, Process & Energy Department, Faculty of Mechanical, Maritime and Materials Engineering, Delft University of Technology, Leeghwaterstraat 39, 2628CB Delft, The Netherlands

2. Institute of Technical Thermodynamics, RWTH Aachen University, 52056 Aachen, Germany

Funder

Nederlandse Organisatie voor Wetenschappelijk Onderzoek

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

http://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00939

Reference59 articles.

1. Economou, I.; Krokidas, P.; Michalis, V.; Moultos, O.; Tsimpanogiannis, I.; Vergadou, N. Water-Food-Energy Nexus Process. Technol. Challenges; CRC Press: Boca Raton, 2017; Chapter 13, pp 633–660.

2. Computer Simulation of Liquids

3. Fast Parallel Algorithms for Short-Range Molecular Dynamics

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