Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations

Bibliographic Details
Main Authors: Wen Tao, Chuncheng Zhu, Qian Xu, Shenggang Li, Xiaolu Xiong, Hongwei Cheng, Xingli Zou, Xionggang Lu
Format: Article
Language:English
Published: American Chemical Society 2020-08-01
Series:ACS Omega
Online Access:https://doi.org/10.1021/acsomega.0c01713
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author Wen Tao
Chuncheng Zhu
Qian Xu
Shenggang Li
Xiaolu Xiong
Hongwei Cheng
Xingli Zou
Xionggang Lu
author_facet Wen Tao
Chuncheng Zhu
Qian Xu
Shenggang Li
Xiaolu Xiong
Hongwei Cheng
Xingli Zou
Xionggang Lu
author_sort Wen Tao
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publishDate 2020-08-01
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spelling doaj.art-c06c942355824610842d6f382357f0092022-12-21T23:17:10ZengAmerican Chemical SocietyACS Omega2470-13432020-08-01532200902009910.1021/acsomega.0c01713Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles CalculationsWen Tao0Chuncheng Zhu1Qian Xu2Shenggang Li3Xiaolu Xiong4Hongwei Cheng5Xingli Zou6Xionggang Lu7State Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, ChinaState Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, ChinaState Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, ChinaCAS Key Laboratory of Low-Carbon Conversion Science and EngineeringShanghai Advanced Research Institute, Chinese Academy of Sciences, Shanghai, ChinaState Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, ChinaState Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, ChinaState Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, ChinaState Key Laboratory of Advanced Special Steel & Shanghai Key Laboratory of Advanced Ferrometallurgy & School of Materials Science and Engineering, Shanghai University, Shanghai, Chinahttps://doi.org/10.1021/acsomega.0c01713
spellingShingle Wen Tao
Chuncheng Zhu
Qian Xu
Shenggang Li
Xiaolu Xiong
Hongwei Cheng
Xingli Zou
Xionggang Lu
Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations
ACS Omega
title Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations
title_full Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations
title_fullStr Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations
title_full_unstemmed Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations
title_short Electronic Structure and Oxidation Mechanism of Nickel–Copper Converter Matte from First-Principles Calculations
title_sort electronic structure and oxidation mechanism of nickel copper converter matte from first principles calculations
url https://doi.org/10.1021/acsomega.0c01713
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