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计算化学模拟分析蓝晶石族矿物与石英的浮选机理

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采用量子化学计算、分子动力学模拟等手段,对矿物晶体结构和表面性质、矿物与浮选药剂的作用机理进行系统分析,探讨了蓝晶石族矿物与石英的浮选机理.结果表明,蓝晶石、红柱石、硅线石与石英表面性质差异性决定了其可浮性差异,柠檬酸能增加蓝晶石族矿物与石英之间的可浮性差异;计算化学模拟结果与浮选试验规律相吻合.
Flotation Separation Mechanism of Kyanite Group Minerals and Quartz:A Computational Chemistry Simulation
The crystal structure and surface properties of minerals and the mechanism of interaction between minerals and flotation agents were systematically analyzed by means of quantum chemical calculation and molecular dynamics simulation.Meanwhile,the flotation mechanism of kyanite minerals and quartz was discussed.The results show that the differences in the surface properties of kyanite,andalusite,sillimanite and quartz determine the differences in floatability,and citric acid can increase the floatability difference between kyanite minerals and quartz.The simulation result of computational chemistry is consistent with the experimental result of flotation.

kyanite group mineralsquartzflotationcomputational chemistryquantum chemistrymolecular dynamics simulationcitric acid

许洪峰、牛艳萍

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黑龙江省矿业集团有限责任公司,黑龙江哈尔滨 150030

黑龙江科技大学矿业工程学院,黑龙江哈尔滨 150022

蓝晶石族矿物 石英 浮选 计算化学 量子化学 分子动力学模拟 柠檬酸

2024

矿冶工程
长沙矿冶研究院有限责任公司 中国金属学会

矿冶工程

CSTPCD北大核心
影响因子:1.137
ISSN:0253-6099
年,卷(期):2024.44(1)
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