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首页> 外文期刊>International Journal of Mineral Processing >Correlation between reducing power and electronic structure of organic reducing agents used in sulfuric acid leaching of polymetallic nodules
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Correlation between reducing power and electronic structure of organic reducing agents used in sulfuric acid leaching of polymetallic nodules

机译:多金属结核硫酸浸出中有机还原剂还原能力与电子结构的相关性

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摘要

The electronic structures of organic reducing agents used in the leaching of polymetallic nodules and related organic compounds were investigated by means of INDO and CNDO methods of quantum chemistry. It was found that among the electronic structure indices studied, the highest occupied molecular orbital (HOMO) energy of an organic compound correlated best with its reducing power. The HOMO energy of oxalic acid was recommended as the criteria for the selection of effective reducing agents for the acid leaching of polymetallic nodules.
机译:通过量子化学的INDO和CNDO方法研究了用于多金属结核和相关有机化合物浸出的有机还原剂的电子结构。发现在所研究的电子结构指标中,有机化合物的最高占据分子轨道(HOMO)能量与其还原能力最相关。草酸的HOMO能量被推荐作为选择有效还原剂的标准,用于多金属结核的酸浸。

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