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Original Articles

XPS and ab initio calculation of surface states of sulfide minerals: pyrite, chalcopyrite and molybdenite

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Pages 1207-1212 | Received 01 Oct 2006, Accepted 01 Oct 2006, Published online: 04 Mar 2011

Keep up to date with the latest research on this topic with citation updates for this article.

Read on this site (3)

Runqing Liu, Chongyi Zhong, Shangyong Lin, Dongdong He & Wei Sun. (2022) Depression Mechanism of Sodium Sulfide in Flotation Separation of Molybdenite and Bismuthinite. Mineral Processing and Extractive Metallurgy Review 43:6, pages 739-746.
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Yahui Zhang, Zhidong Tang & John Shirokoff. (2021) Study on Flotability and Surface Oxidation of Sulfide Minerals from the Tailing of an Iron-Copper Mine Using Electron Probe Microanalyzer. Mineral Processing and Extractive Metallurgy Review 42:4, pages 213-221.
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Y. Yang, S.N. Tan, A.M. Glenn, S. Harmer, S. Bhargava & M. Chen. (2015) A direct observation of bacterial coverage and biofilm formation by Acidithiobacillus ferrooxidans on chalcopyrite and pyrite surfaces. Biofouling 31:7, pages 575-586.
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Articles from other publishers (38)

Selma Fabiana Bazan, Hélio Anderson Duarte & Guilherme Ferreira de Lima. (2022) A DFT study of the adsorption of O2 and [Fe(H2O)2(OH)3] on the (001) and (112) surfaces of chalcopyrite. Journal of Molecular Modeling 28:9.
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Hao Chen, Jingfeng He, Lingtao Zhu, Bin Liu, Kui Zhou, Jiang Xu & Chengjing Guo. (2022) Eco-friendly oxidation leaching from chalcopyrite powder and kinetics assisted by sodium chloride in organic acid media. Advanced Powder Technology 33:5, pages 103547.
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Dharmendr Kumar, Sriram Goverapet Srinivasan, Vinay Jain & Beena Rai. (2022) Understanding flotation processes at the atomic scale using density functional theory – A case study on adsorption of 2-Mercaptobenzothiazole on chalcopyrite and pyrite surfaces. Applied Surface Science 579, pages 152112.
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Hossein Nourmohamadi, Mehdi D. Esrafili & Valeh Aghazadeh. (2022) A DFT investigation into the effects of As-doping on the electronic structure and electrochemical activity of pyrite (FeS2). Journal of Molecular Graphics and Modelling 110, pages 108040.
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Hossein Nourmohamadi, Valeh Aghazadeh & Mehdi D. Esrafili. (2021) DFT study and electrochemical investigation of Fe3+ion interaction on chalcopyrite (0 0 1)-S and M (M = Cu, Fe) surfaces: A thermodynamic insights. Materials Science and Engineering: B 271, pages 115243.
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Zhenlun Wei, Yubiao Li & Lingyun Huang. (2021) New insight into the anisotropic property and wettability of molybdenite: A DFT study. Minerals Engineering 170, pages 107058.
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Maria Sinche-Gonzalez & Daniel Fornasiero. (2021) Understanding the effect of sulphate in mining-process water on sulphide flotation. Minerals Engineering 165, pages 106865.
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Yang Zhang, Weiqiang Li, Yuanfeng Cai, Yang Qu, Yuguan Pan, Wenlan Zhang & Kuidong Zhao. (2021) Experimental investigation of the reactions between pyrite and aqueous Cu(I) chloride solution at 100–250 °C. Geochimica et Cosmochimica Acta 298, pages 1-20.
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Changtao Wang, Runqing Liu, Meirong Wu, Zhijie Xu, Mengjie Tian, Zhigang Yin, Wei Sun & Chenyang Zhang. (2021) Flotation separation of molybdenite from chalcopyrite using rhodanine-3-acetic acid as a novel and effective depressant. Minerals Engineering 162, pages 106747.
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Hongbo Zhao, Congren Yang, Xian Zhang, Yisheng Zhang & Guanzhou Qiu. 2021. Biohydrometallurgy of Chalcopyrite. Biohydrometallurgy of Chalcopyrite 125 156 .
Hongbo Zhao, Congren Yang, Xian Zhang, Yisheng Zhang & Guanzhou Qiu. 2021. Biohydrometallurgy of Chalcopyrite. Biohydrometallurgy of Chalcopyrite 73 124 .
Zhigang Yin, Shengda Chen, Zhijie Xu, Chenyang Zhang, Jianyong He, Jingxiang Zou, Daixiong Chen & Wei Sun. (2020) Flotation separation of molybdenite from chalcopyrite using an environmentally-efficient depressant L-cysteine and its adsoption mechanism. Minerals Engineering 156, pages 106438.
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Yuri Mikhlin. (2020) X-ray Photoelectron Spectroscopy in Mineral Processing Studies. Applied Sciences 10:15, pages 5138.
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Xiao-tao Huang, Rui Liao, Bao-jun Yang, Shi-chao Yu, Bai-qiang Wu, Mao-xin Hong, Jun Wang, Hong-bo Zhao, Min Gan, Fen Jiao, Wen-qing Qin & Guan-zhou Qiu. (2020) Role and maintenance of redox potential on chalcopyrite biohydrometallurgy: An overview氧化还原电位在黄铜矿生物湿法冶金中的作用及其调控: 综述. Journal of Central South University 27:5, pages 1351-1366.
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Yang Chen, Xumeng Chen & Yongjun Peng. (2020) The effect of sodium hydrosulfide on molybdenite flotation as a depressant of copper sulfides. Minerals Engineering 148, pages 106203.
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Hossein Nourmohamadi, Mehdi D. Esrafili & Valeh Aghazadeh. (2019) Interaction of ferric ion with (001)-S and (001)-M surfaces of chalcopyrite (M = Fe and Cu): Electrochemical insights from DFT calculations. Applied Surface Science 495, pages 143529.
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Rasoul Khaledialidusti, Abhishek Kumar Mishra & Afrooz Barnoush. (2019) CO 2 Adsorption and Activation on the (110) Chalcopyrite Surfaces: A Dispersion-Corrected DFT + U Study . ACS Omega 4:14, pages 15935-15946.
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Zhenlun Wei, Yubiao Li, Huimin Gao, Yangge Zhu, Gujie Qian & Jun Yao. (2019) New insights into the surface relaxation and oxidation of chalcopyrite exposed to O2 and H2O: A first-principles DFT study. Applied Surface Science 492, pages 89-98.
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Vladimir Nasluzov, Aleksey Shor, Alexander Romanchenko, Yevgeny Tomashevich & Yuri Mikhlin. (2019) DFT + U and Low-Temperature XPS Studies of Fe-Depleted Chalcopyrite (CuFeS 2 ) Surfaces: A Focus on Polysulfide Species . The Journal of Physical Chemistry C 123:34, pages 21031-21041.
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Hongbo Zhao, Yisheng Zhang, Xian Zhang, Lu Qian, Menglin Sun, Yu Yang, Yansheng Zhang, Jun Wang, Hyunjung Kim & Guanzhou Qiu. (2019) The dissolution and passivation mechanism of chalcopyrite in bioleaching: An overview. Minerals Engineering 136, pages 140-154.
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Guilherme Ferreira de Lima, Hélio Anderson Duarte & Lars G. M. Pettersson. (2018) X-ray Absorption Near-Edge Spectroscopy Calculations on Pristine and Modified Chalcopyrite Surfaces. The Journal of Physical Chemistry C 122:35, pages 20200-20209.
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Xingfu Zheng, Xuan Pan, Zhenyuan Nie, Yi Yang, Lizhu Liu, Hongying Yang & Jinlan Xia. (2018) Combined DFT and XPS Investigation of Cysteine Adsorption on the Pyrite (1 0 0) Surface. Minerals 8:9, pages 366.
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Yubiao Li, Zhenlun Wei, Qing Xiao, Huimin Gao & Shaoxian Song. (2018) A fundamental DFT study of chalcopyrite surface evolution due to impurity divalent ions during leaching process. Minerals Engineering 121, pages 205-211.
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Zilong Liu, Cong Chen, Hongying Yang, Guobao Chen, Jiushuai Deng, Xi Zhang, Hao Lai, Hongying Luo, Jiaozhong Cai & Linlin Tong. (2018) Synthesis of Hydroxylated Xanthate Salt and Its Use as Novel Selective Depressant in Copper-Molybdenum Separation. Russian Journal of Non-Ferrous Metals 59:3, pages 223-229.
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Zhigang Yin, Yuehua Hu, Wei Sun, Chenyang Zhang, Jianyong He, Zhijie Xu, Jingxiang Zou, Changping Guan, Chenhu Zhang, Qingjun Guan, Shangyong Lin & Sultan Ahmed Khoso. (2018) Adsorption Mechanism of 4-Amino-5-mercapto-1,2,4-triazole as Flotation Reagent on Chalcopyrite. Langmuir 34:13, pages 4071-4083.
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Sascha Thinius, Mazharul M. Islam & Thomas Bredow. (2018) The structure of reconstructed chalcopyrite surfaces. Surface Science 669, pages 1-9.
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Congren Yang, Wenqing Qin, Hongbo Zhao, Jun Wang & Xingjie Wang. (2018) Mixed Potential Plays a Key Role in Leaching of Chalcopyrite: Experimental and Theoretical Analysis. Industrial & Engineering Chemistry Research 57:5, pages 1733-1744.
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Xiaolu Xiong, Xiaoming Hua, Yongfei Zheng, Xionggang Lu, Shenggang Li, Hongwei Cheng & Qian Xu. (2018) Oxidation mechanism of chalcopyrite revealed by X-ray photoelectron spectroscopy and first principles studies. Applied Surface Science 427, pages 233-241.
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Yuri Mikhlin, Vladimir Nasluzov, Alexander Romanchenko, Yevgeny Tomashevich, Alexey Shor & Roberto Félix. (2017) Layered structure of the near-surface region of oxidized chalcopyrite (CuFeS 2 ): hard X-ray photoelectron spectroscopy, X-ray absorption spectroscopy and DFT+U studies . Physical Chemistry Chemical Physics 19:4, pages 2749-2759.
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Vincent H.-Y. Chen, Giuseppe Mallia, Ruth Martínez-Casado & Nicholas M. Harrison. (2015) Surface morphology of : The stability of the polar surface pair . Physical Review B 92:15.
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Huang Tao & Li Dongwei. (2014) Presentation on mechanisms and applications of chalcopyrite and pyrite bioleaching in biohydrometallurgy – a presentation. Biotechnology Reports 4, pages 107-119.
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Y. Li, A.P. Chandra & A.R. Gerson. (2014) Scanning photoelectron microscopy studies of freshly fractured chalcopyrite exposed to O2 and H2O. Geochimica et Cosmochimica Acta 133, pages 372-386.
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Y. Li, N. Kawashima, J. Li, A.P. Chandra & A.R. Gerson. (2013) A review of the structure, and fundamental mechanisms and kinetics of the leaching of chalcopyrite. Advances in Colloid and Interface Science 197-198, pages 1-32.
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Shu-ming WEN, Jiu-shuai DENG, Yong-jun XIAN & Liu DAN. (2013) Theory analysis and vestigial information of surface relaxation of natural chalcopyrite mineral crystal. Transactions of Nonferrous Metals Society of China 23:3, pages 796-803.
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Cláudio de Oliveira, Guilherme Ferreira de Lima, Heitor Avelino de Abreu & Hélio Anderson Duarte. (2012) Reconstruction of the Chalcopyrite Surfaces—A DFT Study. The Journal of Physical Chemistry C 116:10, pages 6357-6366.
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Guilherme Ferreira de Lima, Cláudio de Oliveira, Heitor Avelino de Abreu & Hélio Anderson Duarte. (2011) Water Adsorption on the Reconstructed (001) Chalcopyrite Surfaces. The Journal of Physical Chemistry C 115:21, pages 10709-10717.
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Yuanfeng Cai, Yuguan Pan, Jiyue Xue, Qingfeng Sun, Guizhen Su & Xiang Li. (2009) Comparative XPS study between experimentally and naturally weathered pyrites. Applied Surface Science 255:21, pages 8750-8760.
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Roger Smart & Zhaoming Zhang. 2009. Handbook of Surface and Interface Analysis. Handbook of Surface and Interface Analysis 457 500 .

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