Transport properties of a binary mixture of CO2–N2 from the pair potential energy functions based on a semi-empirical inversion method

doi:10.1088/1674-1056/21/4/045101

Abstract The potential energy surface of a CO₂-N₂ mixture is determined by using an inversion method, together with a new collision integral correlation [J. Phys. Chem. Ref. Data 19 1179 (1990)]. With the new invert potential, the transport properties of CO₂-N₂ mixture are presented in a temperature range from 273.15 K to 3273.15 K at low density by employing the Chapman-Enskog scheme and the Wang Chang-Uhlenbeck-de Boer theory, consisting of a viscosity coefficient, a thermal conductivity coefficient, a binary diffusion coefficient, and a thermal diffusion factor. The accuracy of the predicted results is estimated to be 2% for viscosity, 5% for thermal conductivity, and 10% for binary diffusion coefficient.

Keywords: inversion method potential energy surface CO₂-N₂ mixture transport property

Received: 07 July 2011
Revised: 26 July 2011
Accepted manuscript online:

PACS:	51.10.+y	(Kinetic and transport theory of gases)
	52.25.Fi	(Transport properties)
	31.50.-x	(Potential energy surfaces)
	34.20.-b	(Interatomic and intermolecular potentials and forces, potential energy surfaces for collisions)

Fund: Project supported by the National Natural Science Foundation of China (Grant No. 51006083), the China Postdoctoral Science Foundation (Grant No. 20110491658), and the Fundamental Research Funds for the Central Universities.

Corresponding Authors: Wang Xiao-Po,wangxp@mail.xjtu.edu.cn
E-mail: wangxp@mail.xjtu.edu.cn

Cite this article:

Song Bo(宋渤), Wang Xiao-Po(王晓坡), Yang Fu-Xin(杨富鑫), and Liu Zhi-Gang(刘志刚) Transport properties of a binary mixture of CO₂–N₂ from the pair potential energy functions based on a semi-empirical inversion method 2012 Chin. Phys. B 21 045101

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Transport properties of a binary mixture of CO2–N2 from the pair potential energy functions based on a semi-empirical inversion method

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Transport properties of a binary mixture of CO₂–N₂ from the pair potential energy functions based on a semi-empirical inversion method