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1 The role of overlayered nitride electro-materials for N2 reduction to ammonia [期刊论文]

来源：Frontiers in Catalysis , 2023

作者:Younes Abghoui, Atef Iqbal, Egill Skúlason

关键词:DFT calculations;electrochemical ammonia production;...

使用许可:Unknown

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2 Nicotine as a Catalyst for Chlorination Promoted by Hypochlorous Acid: Experimental and Theoretical Studies [期刊论文]

来源：Journal of the Brazilian Chemical Society , 2023

作者:Ximenes, Valdecir F.;Pavan, Nathalia M.;Souza, Aguinaldo R. de;等

关键词:hypochlorous acid;nicotine;...

使用许可:CC BY

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3 Synthesis, DFT investigations, antioxidant, antibacterial activity and SAR-study of novel thiophene-2-carboxamide derivatives [期刊论文]

来源：BMC Chemistry , 2023

作者:Heba M. Metwally;Norhan A. Khalaf;Ehab Abdel-Latif;等

关键词:2-Chloroacetamide;Thiophene-2-carboxamide;...

使用许可:CC BY

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4 DFT studies of solvent effect in hydrogen abstraction reactions from different allyl-type monomers with benzoyl radical [期刊论文]

来源：BMC Chemistry , 2023

作者:Shibo Lin;Xi Chen;Xuanhao Li;等

关键词:Allyl;Solvent effect;...

使用许可:CC BY

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5 Ruthenium tetroxide oxidation of N-methyl-isoxazolidine: Computational mechanistic study [期刊论文]

来源：Arabian Journal of Chemistry , 2022

作者:Laura Legnani;Daniela Iannazzo;Salvatore V. Giofrè;等

关键词:Oxidation;DFT calculations;...

使用许可:Unknown

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6 Light-assisted ozone gas-sensing performance of SnO2 nanoparticles: Experimental and theoretical insights [期刊论文]

来源：Sensors and Actuators Reports , 2022

作者:Marisa C. de Oliveira;Ariadne C. Catto;Marcio D. Teodoro;等

关键词:SnO2;Nanoparticles;...

使用许可:Unknown

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