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Author:

Kang, Zhangyang (Kang, Zhangyang.) | Robelin, Christian (Robelin, Christian.) | He, Maogang (He, Maogang.) (Scholars:何茂刚) | Chartrand, Patrice (Chartrand, Patrice.)

Indexed by:

SCIE EI Scopus

Abstract:

A careful evaluation and optimization of all available phase equilibrium and thermodynamic data for the (KF + YF3), (KCl + YCl3) and (YF3 + YbF3) binary systems was performed to obtain optimized model parameters for all solid and liquid phases. After the discussion of four different optimization strategies, the Modified Quasichemical Model in the pair approximation with two short-range ordering compositions near X-YX3 = 0.25 and 0.4 (X = Cl, F) proved to be a suitable method to model the molten salt phase of the (KX + YX3) binary systems. The liquid phase of the (YF3 + YbF3) binary system was considered to be ideal. All thermodynamic data (phase diagram, enthalpy of mixing, activity) that are available for the three binary systems are reproduced within experimental error limits. (C) 2016 Elsevier Ltd. All rights reserved.

Keyword:

Fluoride crystals Thermodynamic database Thermodynamic modelling Yttrium halides

Author Community:

  • [ 1 ] [Kang, Zhangyang; He, Maogang] Xi An Jiao Tong Univ, Sch Energy & Power Engn, Minist Educ, Key Lab Thermo Fluid Sci & Engn, Xian 710049, Peoples R China
  • [ 2 ] [Kang, Zhangyang; Robelin, Christian; Chartrand, Patrice] Ecole Polytech, Dept Chem Engn, CRCT, CP 6079,Succursale Downtown, Montreal, PQ H3C 3A7, Canada
  • [ 3 ] [Kang, Zhangyang]Xi An Jiao Tong Univ, Sch Energy & Power Engn, Minist Educ, Key Lab Thermo Fluid Sci & Engn, Xian 710049, Peoples R China
  • [ 4 ] [He, Maogang]Xi An Jiao Tong Univ, Sch Energy & Power Engn, Minist Educ, Key Lab Thermo Fluid Sci & Engn, Xian 710049, Peoples R China
  • [ 5 ] [Kang, Zhangyang]Ecole Polytech, Dept Chem Engn, CRCT, CP 6079,Succursale Downtown, Montreal, PQ H3C 3A7, Canada
  • [ 6 ] [Robelin, Christian]Ecole Polytech, Dept Chem Engn, CRCT, CP 6079,Succursale Downtown, Montreal, PQ H3C 3A7, Canada
  • [ 7 ] [Chartrand, Patrice]Ecole Polytech, Dept Chem Engn, CRCT, CP 6079,Succursale Downtown, Montreal, PQ H3C 3A7, Canada

Reprint Author's Address:

  • Ecole Polytech, Dept Chem Engn, CRCT, CP 6079,Succursale Downtown, Montreal, PQ H3C 3A7, Canada.

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Source :

JOURNAL OF CHEMICAL THERMODYNAMICS

ISSN: 0021-9614

Year: 2016

Volume: 98

Page: 242-253

2 . 7 2 6

JCR@2016

3 . 1 7 8

JCR@2020

ESI Discipline: CHEMISTRY;

ESI HC Threshold:177

JCR Journal Grade:2

CAS Journal Grade:2

Cited Count:

WoS CC Cited Count: 6

SCOPUS Cited Count: 8

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 1

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