Diffusion coefficient calculation of iron in liquid lead using molecular dynamics method with new mixing rule for Lennard-Jones potential parameters
Joint Authors
Arkundato, Artoto
Monado, Fiber
Sugihartono, Iwan
Rivai, Abu Khalid
Suud, Zaki
Source
Issue
Vol. 50, Issue 3 B (31 Jul. 2023), pp.1-15, 15 p.
Publisher
Kuwait University Academic Publication Council
Publication Date
2023-07-31
Country of Publication
Kuwait
No. of Pages
15
Main Subjects
Abstract EN
The diffusion coefficient data of materials are crucial for several applications, and can be calculated theoretically up to considerable accuracies.
Using molecular dynamics simulation it is possible to compute this property for several conditions as temperature and pressure.
The corrosion phenomena of steel types in the fast nuclear reactor can be correlated and studied based on the the diffusion process of iron atoms that dissolve into a liquid lead coolant via molecular dynamics methods using certain potential energy.
A widely type of the interatomic interaction potential of
American Psychological Association (APA)
Arkundato, Artoto& Monado, Fiber& Sugihartono, Iwan& Rivai, Abu Khalid& Suud, Zaki. 2023. Diffusion coefficient calculation of iron in liquid lead using molecular dynamics method with new mixing rule for Lennard-Jones potential parameters. Kuwait Journal of Science،Vol. 50, no. 3 B, pp.1-15.
https://search.emarefa.net/detail/BIM-1500042
Modern Language Association (MLA)
Arkundato, Artoto…[et al.]. Diffusion coefficient calculation of iron in liquid lead using molecular dynamics method with new mixing rule for Lennard-Jones potential parameters. Kuwait Journal of Science Vol. 50, no. 3 B (Jul. 2023), pp.1-15.
https://search.emarefa.net/detail/BIM-1500042
American Medical Association (AMA)
Arkundato, Artoto& Monado, Fiber& Sugihartono, Iwan& Rivai, Abu Khalid& Suud, Zaki. Diffusion coefficient calculation of iron in liquid lead using molecular dynamics method with new mixing rule for Lennard-Jones potential parameters. Kuwait Journal of Science. 2023. Vol. 50, no. 3 B, pp.1-15.
https://search.emarefa.net/detail/BIM-1500042
Data Type
Journal Articles
Language
English
Notes
Includes bibliographical references : p. 13-15
Record ID
BIM-1500042