{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,7]],"date-time":"2026-10-07T10:47:08Z","timestamp":1791370028262,"version":"4.3.1"},"reference-count":71,"publisher":"Royal Society of Chemistry (RSC)","issue":"41","license":[{"start":{"date-parts":[[2023,10,2]],"date-time":"2023-10-02T00:00:00Z","timestamp":1696204800000},"content-version":"vor","delay-in-days":274,"URL":"http:\/\/creativecommons.org\/licenses\/by-nc\/3.0\/"}],"funder":[{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["61774056"],"award-info":[{"award-number":["61774056"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["rsc.org"],"crossmark-restriction":true},"short-container-title":["RSC Adv."],"abstract":"<jats:p>The design of new gas sensors and scavengers of volatile organic compounds (VOCs) is desirable for VOC enriching, separation and utilization.<\/jats:p>","DOI":"10.1039\/d3ra05573f","type":"journal-article","created":{"date-parts":[[2023,10,2]],"date-time":"2023-10-02T03:12:16Z","timestamp":1696216336000},"page":"28703-28712","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":17,"title":["First-principles insights into the C\n                    <sub>6<\/sub>\n                    N\n                    <sub>7<\/sub>\n                    monolayer as a highly efficient sensor and scavenger for the detection of selective volatile organic compounds"],"prefix":"10.1039","volume":"13","author":[{"given":"Ruishan","family":"Zhang","sequence":"first","affiliation":[{"name":"School of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Zihao","family":"Wang","sequence":"additional","affiliation":[{"name":"School of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Qihua","family":"Hou","sequence":"additional","affiliation":[{"name":"School of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Xiaobo","family":"Yuan","sequence":"additional","affiliation":[{"name":"School of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7376-0738","authenticated-orcid":false,"given":"Yongliang","family":"Yong","sequence":"additional","affiliation":[{"name":"School of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, China"},{"name":"Advanced Materials Science Innovation Center, Longmen Laboratory, Luoyang 471003, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Hongling","family":"Cui","sequence":"additional","affiliation":[{"name":"School of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Xinli","family":"Li","sequence":"additional","affiliation":[{"name":"Advanced Materials Science Innovation Center, Longmen Laboratory, Luoyang 471003, China"},{"name":"School of Materials Science and Engineering, Henan University of Science and Technology, Luoyang 471023, China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"292","published-online":{"date-parts":[[2023]]},"reference":[{"key":"D3RA05573F\/cit1\/1","doi-asserted-by":"crossref","first-page":"33","DOI":"10.1515\/revac-2021-0127","volume":"40","author":"Galstyan","year":"2021","journal-title":"Rev. Anal. Chem."},{"key":"D3RA05573F\/cit2\/1","doi-asserted-by":"crossref","first-page":"2200830","DOI":"10.1002\/adem.202200830","volume":"25","author":"Rath","year":"2023","journal-title":"Adv. Eng. Mater."},{"key":"D3RA05573F\/cit3\/1","doi-asserted-by":"crossref","first-page":"6364","DOI":"10.1039\/C9CS00778D","volume":"49","author":"Li","year":"2020","journal-title":"Chem. Soc. Rev."},{"key":"D3RA05573F\/cit4\/1","doi-asserted-by":"crossref","first-page":"229","DOI":"10.1007\/978-3-030-63245-8_11","volume":"1","author":"Singh","year":"2021","journal-title":"Nanosensors for Environment, Food and Agriculture"},{"key":"D3RA05573F\/cit5\/1","doi-asserted-by":"crossref","first-page":"7080","DOI":"10.1021\/acsnano.1c10827","volume":"16","author":"Khatib","year":"2022","journal-title":"ACS Nano"},{"key":"D3RA05573F\/cit6\/1","doi-asserted-by":"crossref","first-page":"108893","DOI":"10.1016\/j.inoche.2021.108893","volume":"133","author":"John","year":"2021","journal-title":"Inorg. Chem. Commun."},{"key":"D3RA05573F\/cit7\/1","doi-asserted-by":"crossref","first-page":"1598","DOI":"10.3390\/molecules28041598","volume":"28","author":"Epping","year":"2023","journal-title":"Molecules"},{"key":"D3RA05573F\/cit8\/1","doi-asserted-by":"crossref","first-page":"2001071","DOI":"10.1002\/aelm.202001071","volume":"7","author":"Tan","year":"2021","journal-title":"Adv. Electron. Mater."},{"key":"D3RA05573F\/cit9\/1","doi-asserted-by":"crossref","first-page":"1373","DOI":"10.1021\/acssensors.2c02810","volume":"8","author":"Wang","year":"2023","journal-title":"ACS Sens."},{"key":"D3RA05573F\/cit10\/1","doi-asserted-by":"crossref","first-page":"214502","DOI":"10.1016\/j.ccr.2022.214502","volume":"461","author":"Kumar","year":"2022","journal-title":"Coord. Chem. Rev."},{"key":"D3RA05573F\/cit11\/1","doi-asserted-by":"crossref","first-page":"116556","DOI":"10.1016\/j.envres.2023.116556","volume":"234","author":"Behera","year":"2023","journal-title":"Environ. Res."},{"key":"D3RA05573F\/cit12\/1","doi-asserted-by":"crossref","first-page":"116674","DOI":"10.1016\/j.envres.2023.116674","volume":"235","author":"Patel","year":"2023","journal-title":"Environ. Res."},{"key":"D3RA05573F\/cit13\/1","doi-asserted-by":"crossref","first-page":"021304","DOI":"10.1063\/1.4983310","volume":"4","author":"Yang","year":"2017","journal-title":"Appl. Phys. Rev."},{"key":"D3RA05573F\/cit14\/1","doi-asserted-by":"crossref","first-page":"478","DOI":"10.1021\/acs.chemrev.8b00311","volume":"119","author":"Meng","year":"2019","journal-title":"Chem. Rev."},{"key":"D3RA05573F\/cit15\/1","doi-asserted-by":"crossref","first-page":"9863038","DOI":"10.34133\/2021\/9863038","volume":"2021","author":"Cao","year":"2021","journal-title":"Research"},{"key":"D3RA05573F\/cit16\/1","doi-asserted-by":"crossref","first-page":"032002","DOI":"10.1088\/2053-1583\/ab7bc5","volume":"7","author":"Buckley","year":"2020","journal-title":"2D Mater."},{"key":"D3RA05573F\/cit17\/1","doi-asserted-by":"crossref","first-page":"2283","DOI":"10.1039\/C1CS15270J","volume":"41","author":"Liu","year":"2012","journal-title":"Chem. Soc. Rev."},{"key":"D3RA05573F\/cit18\/1","doi-asserted-by":"crossref","first-page":"53","DOI":"10.1016\/j.trac.2017.04.003","volume":"91","author":"Justino","year":"2017","journal-title":"TrAC, Trends Anal. Chem."},{"key":"D3RA05573F\/cit19\/1","doi-asserted-by":"crossref","first-page":"1326","DOI":"10.3390\/ma15041326","volume":"15","author":"Leve","year":"2022","journal-title":"Materials"},{"key":"D3RA05573F\/cit20\/1","doi-asserted-by":"crossref","first-page":"2104058","DOI":"10.1002\/adfm.202104058","volume":"31","author":"Feng","year":"2021","journal-title":"Adv. Funct. Mater."},{"key":"D3RA05573F\/cit21\/1","doi-asserted-by":"crossref","first-page":"103182","DOI":"10.1016\/j.mtcomm.2022.103182","volume":"30","author":"Ghosh","year":"2022","journal-title":"Mater. Today Commun."},{"key":"D3RA05573F\/cit22\/1","doi-asserted-by":"crossref","first-page":"122745","DOI":"10.1016\/j.talanta.2021.122745","volume":"235","author":"Chen","year":"2021","journal-title":"Talanta"},{"key":"D3RA05573F\/cit23\/1","doi-asserted-by":"crossref","first-page":"277","DOI":"10.1007\/s00894-021-04892-0","volume":"27","author":"Walia","year":"2021","journal-title":"J. Mol. Model."},{"key":"D3RA05573F\/cit24\/1","doi-asserted-by":"crossref","first-page":"651","DOI":"10.3390\/electronics4030651","volume":"4","author":"Varghese","year":"2015","journal-title":"Electronics"},{"key":"D3RA05573F\/cit25\/1","doi-asserted-by":"crossref","first-page":"1702168","DOI":"10.1002\/adfm.201702168","volume":"27","author":"Liu","year":"2017","journal-title":"Adv. Funct. Mater."},{"key":"D3RA05573F\/cit26\/1","doi-asserted-by":"crossref","first-page":"3092","DOI":"10.1039\/C5EE01895A","volume":"8","author":"Zhang","year":"2015","journal-title":"Energy Environ. Sci."},{"key":"D3RA05573F\/cit27\/1","doi-asserted-by":"crossref","first-page":"128","DOI":"10.1038\/s41524-020-00393-5","volume":"6","author":"Bu","year":"2020","journal-title":"npj Comput. Mater."},{"key":"D3RA05573F\/cit28\/1","doi-asserted-by":"crossref","first-page":"6486","DOI":"10.1038\/ncomms7486","volume":"6","author":"Mahmood","year":"2015","journal-title":"Nat. Commun."},{"key":"D3RA05573F\/cit29\/1","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1039\/D0TA07437C","volume":"9","author":"Tan","year":"2021","journal-title":"J. Mater. Chem. A"},{"key":"D3RA05573F\/cit30\/1","doi-asserted-by":"crossref","first-page":"2001767","DOI":"10.1002\/advs.202001767","volume":"7","author":"Tian","year":"2020","journal-title":"Adv. Sci."},{"key":"D3RA05573F\/cit31\/1","doi-asserted-by":"crossref","first-page":"11075","DOI":"10.1039\/D0TA01973A","volume":"8","author":"Barrio","year":"2020","journal-title":"J. Mater. Chem. A"},{"key":"D3RA05573F\/cit32\/1","doi-asserted-by":"crossref","first-page":"332","DOI":"10.1016\/j.carbon.2021.07.025","volume":"183","author":"Kumar","year":"2021","journal-title":"Carbon"},{"key":"D3RA05573F\/cit33\/1","doi-asserted-by":"crossref","first-page":"3047","DOI":"10.1016\/j.cclet.2020.07.048","volume":"31","author":"Yang","year":"2020","journal-title":"Chin. Chem. Lett."},{"key":"D3RA05573F\/cit34\/1","doi-asserted-by":"crossref","first-page":"488","DOI":"10.1016\/j.apsusc.2019.05.040","volume":"487","author":"Yong","year":"2019","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit35\/1","doi-asserted-by":"crossref","first-page":"700","DOI":"10.3390\/nano13040700","volume":"13","author":"Wasfi","year":"2023","journal-title":"Nanomaterials"},{"key":"D3RA05573F\/cit36\/1","doi-asserted-by":"crossref","first-page":"151579","DOI":"10.1016\/j.apsusc.2021.151579","volume":"573","author":"Panigrahi","year":"2022","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit37\/1","doi-asserted-by":"crossref","first-page":"816","DOI":"10.3390\/cryst13050816","volume":"13","author":"Liu","year":"2023","journal-title":"Crystals"},{"key":"D3RA05573F\/cit38\/1","doi-asserted-by":"crossref","first-page":"125308","DOI":"10.1063\/1.5128803","volume":"9","author":"Zhao","year":"2019","journal-title":"AIP Adv."},{"key":"D3RA05573F\/cit39\/1","doi-asserted-by":"crossref","first-page":"138121","DOI":"10.1016\/j.cplett.2020.138121","volume":"762","author":"Agrawal","year":"2021","journal-title":"Chem. Phys. Lett."},{"key":"D3RA05573F\/cit40\/1","doi-asserted-by":"crossref","first-page":"2200611","DOI":"10.1002\/adts.202200611","volume":"6","author":"Ma","year":"2023","journal-title":"Adv. Theory Simul."},{"key":"D3RA05573F\/cit41\/1","doi-asserted-by":"crossref","first-page":"145759","DOI":"10.1016\/j.apsusc.2020.145759","volume":"512","author":"Cui","year":"2020","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit42\/1","doi-asserted-by":"crossref","first-page":"154806","DOI":"10.1016\/j.apsusc.2022.154806","volume":"606","author":"Yong","year":"2022","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit43\/1","doi-asserted-by":"crossref","first-page":"29371","DOI":"10.1016\/j.ijhydene.2022.06.242","volume":"47","author":"Yong","year":"2022","journal-title":"Int. J. Hydrogen Energy"},{"key":"D3RA05573F\/cit44\/1","doi-asserted-by":"crossref","first-page":"1121","DOI":"10.3390\/nano13061121","volume":"13","author":"Hammud","year":"2023","journal-title":"Nanomaterials"},{"key":"D3RA05573F\/cit45\/1","doi-asserted-by":"crossref","first-page":"102254","DOI":"10.1016\/j.surfin.2022.102254","volume":"33","author":"Zhang","year":"2022","journal-title":"Surf. Interfaces"},{"key":"D3RA05573F\/cit46\/1","doi-asserted-by":"crossref","first-page":"153129","DOI":"10.1016\/j.apsusc.2022.153129","volume":"591","author":"Yong","year":"2022","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit47\/1","doi-asserted-by":"crossref","first-page":"21994","DOI":"10.1016\/j.ijhydene.2021.04.053","volume":"46","author":"Hu","year":"2021","journal-title":"Int. J. Hydrogen Energy"},{"key":"D3RA05573F\/cit48\/1","doi-asserted-by":"crossref","first-page":"102971","DOI":"10.1016\/j.surfin.2023.102971","volume":"39","author":"Wang","year":"2023","journal-title":"Surf. Interfaces"},{"key":"D3RA05573F\/cit49\/1","doi-asserted-by":"crossref","first-page":"157090","DOI":"10.1016\/j.apsusc.2023.157090","volume":"626","author":"Yuan","year":"2023","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit50\/1","doi-asserted-by":"crossref","first-page":"116149","DOI":"10.1016\/j.envres.2023.116149","volume":"231","author":"Kumar","year":"2023","journal-title":"Environ. Res."},{"key":"D3RA05573F\/cit51\/1","doi-asserted-by":"crossref","first-page":"149383","DOI":"10.1016\/j.apsusc.2021.149383","volume":"551","author":"Yong","year":"2021","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit52\/1","doi-asserted-by":"crossref","first-page":"147756","DOI":"10.1016\/j.apsusc.2020.147756","volume":"536","author":"Aghaei","year":"2021","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit53\/1","doi-asserted-by":"crossref","first-page":"442","DOI":"10.1016\/j.apsusc.2018.05.051","volume":"453","author":"Wang","year":"2018","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit54\/1","doi-asserted-by":"crossref","first-page":"1764","DOI":"10.1016\/j.scib.2021.05.007","volume":"66","author":"Zhao","year":"2021","journal-title":"Sci. Bull."},{"key":"D3RA05573F\/cit55\/1","doi-asserted-by":"crossref","first-page":"142102","DOI":"10.1063\/5.0060496","volume":"119","author":"Bafekry","year":"2021","journal-title":"Appl. Phys. Lett."},{"key":"D3RA05573F\/cit56\/1","doi-asserted-by":"crossref","first-page":"075707","DOI":"10.1088\/1361-6528\/ac31e7","volume":"33","author":"Bafekry","year":"2022","journal-title":"Nanotechnology"},{"key":"D3RA05573F\/cit57\/1","doi-asserted-by":"crossref","first-page":"152270","DOI":"10.1016\/j.apsusc.2021.152270","volume":"583","author":"Bafekry","year":"2022","journal-title":"Appl. Surf. Sci."},{"key":"D3RA05573F\/cit58\/1","doi-asserted-by":"crossref","first-page":"230","DOI":"10.1016\/j.carbon.2022.03.068","volume":"194","author":"Mortazavi","year":"2022","journal-title":"Carbon"},{"key":"D3RA05573F\/cit59\/1","doi-asserted-by":"crossref","first-page":"056101","DOI":"10.1063\/5.0098022","volume":"121","author":"Mortazavi","year":"2022","journal-title":"Appl. Phys. Lett."},{"key":"D3RA05573F\/cit60\/1","doi-asserted-by":"crossref","first-page":"508","DOI":"10.1063\/1.458452","volume":"92","author":"Delley","year":"1990","journal-title":"J. Chem. Phys."},{"key":"D3RA05573F\/cit61\/1","doi-asserted-by":"crossref","first-page":"7756","DOI":"10.1063\/1.1316015","volume":"113","author":"Delley","year":"2000","journal-title":"J. Chem. Phys."},{"key":"D3RA05573F\/cit62\/1","doi-asserted-by":"crossref","first-page":"136406","DOI":"10.1103\/PhysRevLett.100.136406","volume":"100","author":"Perdew","year":"2008","journal-title":"Phys. Rev. Lett."},{"key":"D3RA05573F\/cit63\/1","doi-asserted-by":"crossref","first-page":"1787","DOI":"10.1002\/jcc.20495","volume":"27","author":"Grimme","year":"2006","journal-title":"J. Comput. Chem."},{"key":"D3RA05573F\/cit64\/1","doi-asserted-by":"crossref","first-page":"1494","DOI":"10.1103\/PhysRevLett.43.1494","volume":"43","author":"Hamann","year":"1979","journal-title":"Phys. Rev. Lett."},{"key":"D3RA05573F\/cit65\/1","doi-asserted-by":"crossref","first-page":"1748","DOI":"10.1103\/PhysRevB.16.1748","volume":"16","author":"Monkhorst","year":"1977","journal-title":"Phys. Rev. B: Solid State"},{"key":"D3RA05573F\/cit66\/1","doi-asserted-by":"crossref","first-page":"129","DOI":"10.1007\/BF00549096","volume":"44","author":"Hirshfeld","year":"1977","journal-title":"Theor. Chim. Acta"},{"key":"D3RA05573F\/cit67\/1","doi-asserted-by":"crossref","first-page":"567","DOI":"10.1524\/zkri.220.5.567.65075","volume":"220","author":"Clark","year":"2005","journal-title":"Z. Kristallogr."},{"key":"D3RA05573F\/cit68\/1","doi-asserted-by":"crossref","first-page":"213","DOI":"10.1016\/j.carbon.2020.02.078","volume":"163","author":"Hussain","year":"2020","journal-title":"Carbon"},{"key":"D3RA05573F\/cit69\/1","doi-asserted-by":"crossref","first-page":"9242","DOI":"10.1039\/D1TC01510A","volume":"9","author":"Aasi","year":"2021","journal-title":"J. Mater. Chem. C"},{"key":"D3RA05573F\/cit70\/1","doi-asserted-by":"crossref","first-page":"105208","DOI":"10.1016\/j.rinp.2022.105208","volume":"33","author":"Yong","year":"2022","journal-title":"Results Phys."},{"key":"D3RA05573F\/cit71\/1","doi-asserted-by":"crossref","first-page":"271","DOI":"10.1016\/j.cplett.2004.02.026","volume":"387","author":"Peng","year":"2004","journal-title":"Chem. Phys. Lett."}],"container-title":["RSC Advances"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.rsc.org\/en\/content\/articlepdf\/2023\/RA\/D3RA05573F","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,7,7]],"date-time":"2026-07-07T18:15:56Z","timestamp":1783448156000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.rsc.org\/ra\/article\/13\/41\/28703-28712\/825088"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023]]},"references-count":71,"journal-issue":{"issue":"41","published-print":{"date-parts":[[2023,9,26]]}},"URL":"https:\/\/doi.org\/10.1039\/d3ra05573f","relation":{"has-review":[{"id-type":"doi","id":"10.1039\/D3RA05573F\/v1\/review2","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D3RA05573F\/v2\/decision1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D3RA05573F\/v2\/response1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D3RA05573F\/v1\/review1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D3RA05573F\/v1\/decision1","asserted-by":"object"},{"id-type":"doi","id":"10.1039\/D3RA05573F\/v2\/review1","asserted-by":"object"}]},"ISSN":["2046-2069"],"issn-type":[{"value":"2046-2069","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023]]}}}