Title Details: | |
Molecular Simulation |
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Authors: |
Koutselos, Andreas |
Reviewer: |
Diakonos, Fotios |
Subject: | NATURAL SCIENCES AND AGRICULTURAL SCIENCES > CHEMISTRY > PHYSICAL CHEMISTRY NATURAL SCIENCES AND AGRICULTURAL SCIENCES > CHEMISTRY > PHYSICAL CHEMISTRY > THERMODYNAMICS NATURAL SCIENCES AND AGRICULTURAL SCIENCES > CHEMISTRY > PHYSICAL CHEMISTRY > ENTROPY NATURAL SCIENCES AND AGRICULTURAL SCIENCES > CHEMISTRY > PHYSICAL CHEMISTRY > ENTHALPY NATURAL SCIENCES AND AGRICULTURAL SCIENCES > CHEMISTRY > PHYSICAL CHEMISTRY > EQUATION OF STATE |
Description: | |
Abstract: |
The molecular motion can be reproduced through integration of the equation of motion of the particles through the use of computers. In this chapter we present the calculation of properties based on the method of molecular dynamics. The procedure produces mean molecular properties correlation and transport properties. The results depend on the interaction potentials, as well as the accuracy and the speed of the calculation methods.
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Linguistic Editors: |
Klada, Nektaria |
Technical Editors: |
Zinas, Nikolaos |
Type: |
Chapter |
Creation Date: | 2015 |
Item Details: | |
License: |
http://creativecommons.org/licenses/by-nc-nd/3.0/gr |
Handle | http://hdl.handle.net/11419/5065 |
Bibliographic Reference: | Koutselos, A. (2015). Molecular Simulation [Chapter]. In Koutselos, A. 2015. Statistical Thermodynamics [Undergraduate textbook]. Kallipos, Open Academic Editions. https://hdl.handle.net/11419/5065 |
Language: |
Greek |
Is Part of: |
Statistical Thermodynamics |
Number of pages |
17 |
Version: |
1st ed. |
Publication Origin: |
Kallipos, Open Academic Editions |