In this study, the corrosion electrochemistry and corrosion behavior of two steels were studied under the simulated alumina production conditions. The corrosion rate of 16Mn steel is greater than that of Q235 steel. The effect of S concentration on corrosion rate was significantly higher than that of SO. The synergistic corrosion rates of Q235 and 16Mn steels increase at first and then decrease with the sulfur content, and the peak value appears when the concentration of S and SO is 4 g/L and 3 g/L respectively. There are two main types of corrosion products: one is surface octahedral grain, which is composed of FeO, FeO and AlO.The other is the interlayer corrosion between the surface layer and the matrix, which is composed of FeS, FeS and NaFeO.The formation mechanism of the corrosion and corrosion mechanism were obtained by analyzing the phenomenon of ion competitive adsorption. Further validation and analysis of ion competition adsorption phenomenon were conducted using first-principles calculations based on density functional theory (DFT). The formation of corrosion products on the steel surface was investigated at an ion level, and the adsorption energies of OH and S at the top site of Fe(110) surface were calculated. It was found that S is more likely to be adsorbed on the Fe(110) surface compared to OH. The corrosion mechanism of steel is discussed preliminarily.
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http://dx.doi.org/10.1038/s41598-024-72639-x | DOI Listing |
J Comput Chem
January 2025
Department of Chemistry, National University of Singapore, Singapore.
Corrosion inhibitors are widely used to mitigate safety risks and economic losses in engineering, yet post-adsorption processes remain underexplored. In this study, we employed density functional theory calculations with a periodic model to investigate the dissociation mechanisms of imidazole on the Fe(100) surface. Imidazole was found to adsorb optimally in a parallel orientation, with an adsorption energy of -0.
View Article and Find Full Text PDFJ Colloid Interface Sci
January 2025
Key Laboratory of Eco-chemical Engineering, International Science and Technology Cooperation Base of Eco-chemical Engineering and Green Manufacturing, College of Chemistry and Molecular Engineering, Qingdao University of Science and Technology, Qingdao 266042 China. Electronic address:
It is imperative to investigate more cost-effective, long-lasting, efficient, and reliable non-noble metal electrocatalysts for the oxygen evolution reaction (OER) in hydrogen production via water splitting. Metal-organic complexes have been extensively researched and utilized for this purpose, yet their transformation in this process remains intriguing and underexplored. To enable a comprehensive comparison, we synthesized three types of metal-organic complexes with varying morphologies using the same raw material.
View Article and Find Full Text PDFInt J Biol Macromol
January 2025
Key Laboratory of Automobile Materials, Ministry of Education, and College of Materials Science and Engineering, Jilin University, Changchun 130025, China. Electronic address:
A new type of filler was added to epoxy resin to prepare a composite coating with excellent corrosion and weathering resistance. The simple synthesis process and nonpolluting raw materials of this filler contribute to the development of green chemistry. Specifically, lignin was encapsulated in mesoporous silica, the synergistic effect between the two resulted in the formation of lignin/mesoporous silica composite particles (MSN-L) with excellent ultraviolet (UV) resistance.
View Article and Find Full Text PDFEnviron Res
January 2025
Marine Elements and Marine Environment Division, CSIR-Central Salt & Marine Chemicals Research Institute, Bhavnagar-364 002 (Gujarat), India; Academy of Scientific and Innovative Research (AcSIR), Ghaziabad 201002, India. Electronic address:
Biofouling is a common phenomenon caused by waterborne organisms such as bacteria, diatoms, mussels, barnacles, algae, etc., accumulating on the surfaces of engineering structures submerged under water. This leads to corrosion of such surfaces and decreases their moving efficiency.
View Article and Find Full Text PDFJ Environ Manage
January 2025
Guangdong Provincial Key Laboratory of Chemical Pollution and Environmental Safety & MOE Key Laboratory of Theoretical Chemistry of Environment, School of Environment, South China Normal University, Guangzhou, 510006, China; Institute of Science and Technology Innovation Co., Ltd., South China Normal University, Qingyuan, 511517, China. Electronic address:
Zero-valent iron (ZVI) has been confirmed in enhancing methane production by improving interspecies electron transfer during anaerobic digestion (AD) of waste activated sludge (WAS). In this study, we suppose that sulfidated zero-valent iron (S-ZVI), a semiconductor material, has better property of electron transfer in AD process. Based on two-phase anaerobic digestion process, nitrite and S-ZVI were used separately for improving acidogenic phase and methanogenic phase of anaerobic sludge digestion.
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