Hariharan N Dhandapani, Chanchal Das, Narendra Nath Ghosh, Goutam Biswas*, B. Ramesh Babu* and Subrata Kundu*,
{"title":"用于尿素电氧化的铈-氧化石墨烯纳米复合材料:实验与理论研究","authors":"Hariharan N Dhandapani, Chanchal Das, Narendra Nath Ghosh, Goutam Biswas*, B. Ramesh Babu* and Subrata Kundu*, ","doi":"10.1021/acs.inorgchem.4c0274710.1021/acs.inorgchem.4c02747","DOIUrl":null,"url":null,"abstract":"<p >This study explores the potential of ceria–graphene oxide (CeO<sub>2</sub>-GO) nanocomposites as efficient electrocatalysts for urea electro-oxidation (UOR). This work combines experimental and theoretical investigations and characterization techniques confirm the successful formation of the CeO<sub>2</sub> embedded on graphene oxide sheets. UOR activity was found to be dependent on both OH<sup>–</sup> and urea concentrations. The optimal UOR performance was achieved in a 0.1 M urea and 1.0 M KOH solution, as evidenced by the low Tafel slope of 60 mV/dec and high turnover frequency (TOF) of 1.690 s<sup>–1</sup>. DFT calculations revealed that the CeO<sub>2</sub>-GO nanocomposite exhibited strong urea adsorption due to its favorable bond lengths (Ce–O: 2.58 Å, O–H: 1.77 Å) and high adsorption energy (−1.05 eV). These findings revealed that the CeO<sub>2</sub>-GO nanocomposites are promising as efficient and durable electrocatalysts for urea conversion to valuable products like nitrogen and hydrogen gas, with potential applications in clean energy generation and ammonia synthesis.</p>","PeriodicalId":40,"journal":{"name":"Inorganic Chemistry","volume":"63 34","pages":"16081–16094 16081–16094"},"PeriodicalIF":4.7000,"publicationDate":"2024-08-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Ceria–Graphene Oxide Nanocomposite for Electro-oxidation of Urea: An Experimental and Theoretical Investigation\",\"authors\":\"Hariharan N Dhandapani, Chanchal Das, Narendra Nath Ghosh, Goutam Biswas*, B. Ramesh Babu* and Subrata Kundu*, \",\"doi\":\"10.1021/acs.inorgchem.4c0274710.1021/acs.inorgchem.4c02747\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p >This study explores the potential of ceria–graphene oxide (CeO<sub>2</sub>-GO) nanocomposites as efficient electrocatalysts for urea electro-oxidation (UOR). This work combines experimental and theoretical investigations and characterization techniques confirm the successful formation of the CeO<sub>2</sub> embedded on graphene oxide sheets. UOR activity was found to be dependent on both OH<sup>–</sup> and urea concentrations. The optimal UOR performance was achieved in a 0.1 M urea and 1.0 M KOH solution, as evidenced by the low Tafel slope of 60 mV/dec and high turnover frequency (TOF) of 1.690 s<sup>–1</sup>. DFT calculations revealed that the CeO<sub>2</sub>-GO nanocomposite exhibited strong urea adsorption due to its favorable bond lengths (Ce–O: 2.58 Å, O–H: 1.77 Å) and high adsorption energy (−1.05 eV). These findings revealed that the CeO<sub>2</sub>-GO nanocomposites are promising as efficient and durable electrocatalysts for urea conversion to valuable products like nitrogen and hydrogen gas, with potential applications in clean energy generation and ammonia synthesis.</p>\",\"PeriodicalId\":40,\"journal\":{\"name\":\"Inorganic Chemistry\",\"volume\":\"63 34\",\"pages\":\"16081–16094 16081–16094\"},\"PeriodicalIF\":4.7000,\"publicationDate\":\"2024-08-14\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Inorganic Chemistry\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://pubs.acs.org/doi/10.1021/acs.inorgchem.4c02747\",\"RegionNum\":2,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"CHEMISTRY, INORGANIC & NUCLEAR\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Inorganic Chemistry","FirstCategoryId":"92","ListUrlMain":"https://pubs.acs.org/doi/10.1021/acs.inorgchem.4c02747","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"CHEMISTRY, INORGANIC & NUCLEAR","Score":null,"Total":0}
Ceria–Graphene Oxide Nanocomposite for Electro-oxidation of Urea: An Experimental and Theoretical Investigation
This study explores the potential of ceria–graphene oxide (CeO2-GO) nanocomposites as efficient electrocatalysts for urea electro-oxidation (UOR). This work combines experimental and theoretical investigations and characterization techniques confirm the successful formation of the CeO2 embedded on graphene oxide sheets. UOR activity was found to be dependent on both OH– and urea concentrations. The optimal UOR performance was achieved in a 0.1 M urea and 1.0 M KOH solution, as evidenced by the low Tafel slope of 60 mV/dec and high turnover frequency (TOF) of 1.690 s–1. DFT calculations revealed that the CeO2-GO nanocomposite exhibited strong urea adsorption due to its favorable bond lengths (Ce–O: 2.58 Å, O–H: 1.77 Å) and high adsorption energy (−1.05 eV). These findings revealed that the CeO2-GO nanocomposites are promising as efficient and durable electrocatalysts for urea conversion to valuable products like nitrogen and hydrogen gas, with potential applications in clean energy generation and ammonia synthesis.
期刊介绍:
Inorganic Chemistry publishes fundamental studies in all phases of inorganic chemistry. Coverage includes experimental and theoretical reports on quantitative studies of structure and thermodynamics, kinetics, mechanisms of inorganic reactions, bioinorganic chemistry, and relevant aspects of organometallic chemistry, solid-state phenomena, and chemical bonding theory. Emphasis is placed on the synthesis, structure, thermodynamics, reactivity, spectroscopy, and bonding properties of significant new and known compounds.