Thermodynamic modeling of LiF-NaF-KF-CrF3 system

doi:10.1016/j.jfluchem.2018.02.005

CAS OpenIR > 中科院上海应用物理研究所2011-2018年

	Thermodynamic modeling of LiF-NaF-KF-CrF3 system
	Yin, HQ ; Zhang, P ; An, XH ; Cheng, JH ; Li, X ; Wu, S ; Wu, XJ ; Liu, WG ; Xie, LD
	2018
发表期刊	JOURNAL OF FLUORINE CHEMISTRY
ISSN	0022-1139
卷号	209 页码:6-13
文章类型	期刊论文
摘要	The thermodynamic evaluation and optimizations of the KF-CrF3 and NaF-CrF3 systems were carried out within the framework of CALPHAD (CALculation of PHAse of Diagrams) approach. The liquid phase was described by the associated solution model, and the intermediate phase were treated as stoichiometric compound model. All the model parameters were optimized based on the experimental phase equilibria data from experimental measurements and theoretical predictions (First-principles calculation and empirical equation). A set of self-consistent and reliable thermodynamic parameters was obtained, which can well describe the phase equilibria and thermodynamic properties of the KF-CrF3 and NaF-CrF3 system. Furthermore, the database for the LiF-NaF-KF-CrF3 quaternary system was preliminarily established using Muggianu extrapolation model. Meanwhile, the solubility of CrF3 in FLiNaK at different temperatures was obtained. The calculated value is in good agreement with the reported measurements by ORNL, considering kinetic factor of K3CrF6 involved in FLiNaK.
关键词	Nuclear-power Solubility Fluoride Ternary Alkali Cef3 Melt Thf4 Uf4
DOI	10.1016/j.jfluchem.2018.02.005
收录类别	SCI
语种	英语
WOS记录号	WOS:000430768700002
引用统计
文献类型	期刊论文
条目标识符	http://ir.sinap.ac.cn/handle/331007/29187
专题	中科院上海应用物理研究所2011-2018年
作者单位	1.Yin, HQ 2.Zhang, P 3.An, XH 4.Cheng, JH 5.Li, X 6.Wu, S 7.Wu, XJ 8.Liu, WG 9.Xie, LD
推荐引用方式 GB/T 7714	Yin, HQ,Zhang, P,An, XH,et al. Thermodynamic modeling of LiF-NaF-KF-CrF3 system[J]. JOURNAL OF FLUORINE CHEMISTRY,2018,209:6-13.
APA	Yin, HQ.,Zhang, P.,An, XH.,Cheng, JH.,Li, X.,...&Xie, LD.(2018).Thermodynamic modeling of LiF-NaF-KF-CrF3 system.JOURNAL OF FLUORINE CHEMISTRY,209,6-13.
MLA	Yin, HQ,et al."Thermodynamic modeling of LiF-NaF-KF-CrF3 system".JOURNAL OF FLUORINE CHEMISTRY 209(2018):6-13.

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