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10.1021/acs.langmuir.5c03697 http://scihub22266oqcxt.onion/10.1021/acs.langmuir.5c03697 41359370!?!41359370 Warning: file_get_contents(https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pubmed&id=41359370&cmd=llinks): Failed to open stream: HTTP request failed! HTTP/1.1 429 Too Many Requests in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 215       Langmuir 2025 ; ? (?): ? Nephropedia Template TP {{tp|p=41359370|t=2025. Axial Coordination of Iron Single-Atom Catalysts on Defective Graphene for Electrocatalytic Conversion of Nitric Oxide to Hydroxylamine: A Theoretical Investigation |pdf=|usr=}}{{41359370}} gab.com Text Axial Coordination of Iron Single-Atom Catalysts on Defective Graphene for Electrocatalytic Conversion of Nitric Oxide to Hydroxylamine: A Theoretical Investigation JO: Langmuir http://www.kidney.de/pget.php?&tw=1&pmid=41359370 #FOAvip With the rapid development of modern society and the chemical industry, the demand for hydroxylamine (NH(2)OH) has expanded significantly across diverse fields. However, its conventional synthesis remains challenged by severe pollution and intensive resource consumption. Building upon the experimentally realized Fe@N(4) structure, we propose a ligand coordination strategy to module the electronic structure of iron single-atom catalysts via 15 axial ligands (-F, -Cl, -Br, -I, -N, -O, -OH, -OOH, -CH, -CH(2), -CH(3), -NH(2), -SH, -CN, -SCH(3)), aiming to enhance the electrocatalytic reduction of nitric oxide (NO) to NH(2)OH. Among these, 13 catalysts effectively suppress hydrogen evolution reactions and the generation of undesired byproducts such as NH(3) and N(2)O/N(2). Notably, the -CH(2) ligand significantly alters the local electronic environment of the active site, enabling the activation of NO molecules through an electronic "accept-donate" mechanism. This modulation enhances both the activity and selectivity for NO reduction, ultimately leading to a spontaneous, exothermic conversion of NO to NH(2)OH. This work theoretically proposes a strategy whereby axial coordination can enhance the catalytic reactivity of single-atom catalysts. Twit Text FOAVip Axial Coordination of Iron Single-Atom Catalysts on Defective Graphene for Electrocatalytic Conversion of Nitric Oxide to Hydroxylamine: A Theoretical Investigation ????Langmuir http://www.kidney.de/pget.php?&tw=1&pmid=41359370 #FOAvip Twit Text # Free Paper on # # # # # LINK http://www.kidney.de/pget.php?&tw=1&pmid=41359370 #FOAvip English Wikipedia <ref>{{Cite pmid|41359370}}</ref> Axial Coordination of Iron Single-Atom Catalysts on Defective Graphene for Electrocatalytic Conversion of Nitric Oxide to Hydroxylamine: A Theoretical Investigation #MMPMID41359370 Hu J; Ruan W; Bai Q; Lin W; Guo X; Ding K Langmuir 2025[Dec]; ? (?): ? PMID41359370show ga With the rapid development of modern society and the chemical industry, the demand for hydroxylamine (NH(2)OH) has expanded significantly across diverse fields. However, its conventional synthesis remains challenged by severe pollution and intensive resource consumption. Building upon the experimentally realized Fe@N(4) structure, we propose a ligand coordination strategy to module the electronic structure of iron single-atom catalysts via 15 axial ligands (-F, -Cl, -Br, -I, -N, -O, -OH, -OOH, -CH, -CH(2), -CH(3), -NH(2), -SH, -CN, -SCH(3)), aiming to enhance the electrocatalytic reduction of nitric oxide (NO) to NH(2)OH. Among these, 13 catalysts effectively suppress hydrogen evolution reactions and the generation of undesired byproducts such as NH(3) and N(2)O/N(2). Notably, the -CH(2) ligand significantly alters the local electronic environment of the active site, enabling the activation of NO molecules through an electronic "accept-donate" mechanism. This modulation enhances both the activity and selectivity for NO reduction, ultimately leading to a spontaneous, exothermic conversion of NO to NH(2)OH. This work theoretically proposes a strategy whereby axial coordination can enhance the catalytic reactivity of single-atom catalysts. ?Axial Coordination of Iron Single-Atom Catalysts on Defective Graphene(epmc).pdf DeepDyve Pubget Overpricing