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Behavior of silicon-containing minerals during Bayer digestion

机译:拜耳消化过程中含硅矿物的行为

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Digestion behaviors of several single silicon-containing minerals including kaolinite, illite and pyrophyllite in aluminate solution were investigated. The result shows that the digestion rates of kaolinite, illite and pyrophyllite in aluminate solution were influenced by reaction conditions such as temperature. Adopting quantum chemistry theoretical calculation, using CASTEM procedure module, the slab model of kaolinite, illite, pyrophyllite and their ordinary complete cleavage plane (001) were geometry optimized at GGA-PW91 level. The micro-essence of the different reaction activities among kaolinite, illite, pyrophyllite in aluminate solution was opened out. It is found that the reaction activities of kaolinite, illite, pyrophyllite are obviously different and the reaction activity of pyrophyllite is the highest. The Si—O bond strength of illite is the strongest and its Al—O bond strength is comparatively the weakest, so Si in it is the most difficult to be removed. The Si—O bond strength of pyrophyllite is the weakest, so Si in it is relatively easy to be removed. The micro-electron structure of complete cleavage plane and the Si—O bond strength of kaolinite, illite and pyrophyllite are evidently influenced by the existence of OH-, of which the surface character and the reduction of Si—O bond strength of kaolinite are influenced most greatly by OH-. Therefore, the desilication of kaolinite in alkaline solution at relatively low temperature is easier.
机译:研究了铝酸盐溶液中几种单一含硅矿物(包括高岭石,伊利石和叶蜡石)的消化行为。结果表明,铝酸盐溶液中高岭石,伊利石和叶蜡石的消化速率受温度等反应条件的影响。采用量子化学理论计算,采用CASTEM程序模块,对高岭石,伊利石,叶蜡石及其普通的完全裂解面(001)的平板模型在GGA-PW91水平进行了几何优化。揭示了铝酸盐溶液中高岭石,伊利石,叶蜡石之间不同反应活性的微观本质。发现高岭石,伊利石,叶蜡石的反应活性明显不同,叶蜡石的反应活性最高。伊利石的Si-O键强度最强,而Al-O键强度相对较弱,因此其中的Si最难去除。叶蜡石的Si-O键强度最弱,因此其中的Si相对容易去除。 OH-的存在明显影响高解理石的完全解理面的微电子结构和Si-O键强度,OH-的存在会影响其分解,这会影响高岭石的表面特性和Si-O键强度的降低。最多的是OH-。因此,在相对较低的温度下高岭石在碱性溶液中的脱硅比较容易。

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