Determining diffusion coefficients of oxygen in supercritical water with molecular dynamics

The supercritical water oxidation is a significant way for the waste disposal. The diffusion of the oxygen in the water at the infinite dilution is simulated at 300 K and 1 atm, and 650 K, 673 K, 773 K, 873 K, 973 K, and 250 atm with the molecular dynamics software. The mean squared displacement met...

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Bibliographic Details
Main Authors: Zhao Xiao, Liu Yigang, Zou Jian, Wang Qiuxia, Liu Hao, Zhang Hua, Jin Hui
Format: Article
Language:English
Published: VINCA Institute of Nuclear Sciences 2019-01-01
Series:Thermal Science
Subjects:
Online Access:http://www.doiserbia.nb.rs/img/doi/0354-9836/2019/0354-98361900093Z.pdf