Programs for the dynamic simulation of liquids and solids II. MDIONS : Rigid ions using the Ewald sum (vectorised version on the cray-1)

Published: 1 January 1982| Version 1 | DOI: 10.17632/vzdvfptywb.1
Contributor:
D. Fincham

Description

Title of program: MDIONS (VECTORISED) Catalogue Id: AARM_v2_0 [AARN] Nature of problem Study of the thermodynamic, structural and dynamic properties of ionic solids or liquids, or mixtures thereof. CORRECTION SUMMARY: Vol:Year:Page 28:1983:323 "000A CORRECTION 09/09/82" "Programs for the dynamic simulation of liquids and solids. II. MDIONS: rigid ions using the Ewald sum (vectorised version on the CRAY-1). (C.P.C. 25(1982)177)." D. Fincham Note: correction instructions are contained in source code Versions of this program held in the CPC repository in Mendeley Data AARM_v1_0; MDIONS; 10.1016/0010-4655(82)90032-7 AARM_v2_0; MDIONS (VECTORISED); 10.1016/0010-4655(82)90033-9 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)

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Surface Science, Condensed Matter Physics, Computational Physics

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