Computerized simulation molten LiF-KCl solution by Monte Carlo method II: Relation of structure to thermodynamic properties

Acta Chimica Sinica ›› 1989, Vol. 47 ›› Issue (6): 529-534. Previous Articles Next Articles

Original Articles

LiF-KCl熔盐溶液的Monte Carlo法计算机模拟研究 II: 熔体结构与物性的关系

徐弛;江乃雄;陈念贻

中国科学院上海冶金研究所

发布日期:1989-06-15

Computerized simulation molten LiF-KCl solution by Monte Carlo method II: Relation of structure to thermodynamic properties

XU CHI;JIANG NAICIONG;CHEN NIANYI

Published:1989-06-15

Abstract

The local structures of LiF-KCl molten solns. were simulated by applying the Monte Carlo method. The total potential energies of the melts were calculated and a relationship was established between thermodn. and structure properties.

Key words: CALCULATION, COMPUTERIZED SIMULATION, STRUCTURE AND PROPERTY CORRELATION, POTENTIAL ENERGY, POTASSIUM CHLORIDE, LITHIUM FLUORIDE, FUSED SALTS, MONTECARLO SIMULATIONS

CLC Number:

O645

Cite this article

XU CHI;JIANG NAICIONG;CHEN NIANYI. Computerized simulation molten LiF-KCl solution by Monte Carlo method II: Relation of structure to thermodynamic properties[J]. Acta Chimica Sinica, 1989, 47(6): 529-534.

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LiF-KCl熔盐溶液的Monte Carlo法计算机模拟研究 II: 熔体结构与物性的关系

Computerized simulation molten LiF-KCl solution by Monte Carlo method II: Relation of structure to thermodynamic properties

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