{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,11,3]],"date-time":"2026-11-03T12:41:11Z","timestamp":1793709671413,"version":"4.6.1"},"reference-count":69,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2023,10,1]],"date-time":"2023-10-01T00:00:00Z","timestamp":1696118400000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"funder":[{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["52008282"],"award-info":[{"award-number":["52008282"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100005046","name":"Natural Science Foundation of Heilongjiang Province","doi-asserted-by":"publisher","award":["LH 2022E032"],"award-info":[{"award-number":["LH 2022E032"]}],"id":[{"id":"10.13039\/501100005046","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Chemosphere"],"published-print":{"date-parts":[[2023,10]]},"DOI":"10.1016\/j.chemosphere.2023.139351","type":"journal-article","created":{"date-parts":[[2023,6,26]],"date-time":"2023-06-26T11:47:08Z","timestamp":1687780028000},"page":"139351","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":44,"special_numbering":"C","title":["Synergistic mechanism of formaldehyde adsorption by intrinsic defects and carboxyl groups on the surface of carbon materials"],"prefix":"10.1016","volume":"337","author":[{"given":"Zekun","family":"Sun","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-6090-1677","authenticated-orcid":false,"given":"Zhonghua","family":"Wang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Xue","family":"Yang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0009-0005-8622-4017","authenticated-orcid":false,"given":"Kaibo","family":"An","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Zhibin","family":"Qu","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ziyu","family":"Tang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Shiwei","family":"Lai","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mingqi","family":"He","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Lei","family":"Yang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Bo","family":"Zhou","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-5629-3100","authenticated-orcid":false,"given":"Haiqian","family":"Zhao","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.chemosphere.2023.139351_bib1","doi-asserted-by":"crossref","first-page":"1063","DOI":"10.1016\/j.apsusc.2019.02.040","article-title":"Combined effect of point defects and layer number on the adsorption of benzene and toluene on graphene","volume":"480","author":"Akay","year":"2019","journal-title":"Appl. Surf. Sci."},{"key":"10.1016\/j.chemosphere.2023.139351_bib2","doi-asserted-by":"crossref","first-page":"251","DOI":"10.3390\/nano13020251","article-title":"Efficient detection of nerve agents through carbon nitride quantum dots: a DFT approach","volume":"13","author":"Al-Faiyz","year":"2023","journal-title":"Nanomaterials"},{"key":"10.1016\/j.chemosphere.2023.139351_bib3","doi-asserted-by":"crossref","first-page":"83926","DOI":"10.1039\/C6RA16604K","article-title":"DFT study of Rh-decorated pristine, B-doped and vacancy defected graphene for hydrogen adsorption","volume":"6","author":"Ambrusi","year":"2016","journal-title":"RSC Adv."},{"key":"10.1016\/j.chemosphere.2023.139351_bib4","doi-asserted-by":"crossref","DOI":"10.1016\/j.jece.2022.108723","article-title":"Reasons of low formaldehyde adsorption capacity on activated carbon: multi-scale simulation of dynamic interaction between pore size and functional groups","volume":"10","author":"An","year":"2022","journal-title":"J. Environ. Chem. Eng."},{"key":"10.1016\/j.chemosphere.2023.139351_bib5","doi-asserted-by":"crossref","first-page":"29556","DOI":"10.1021\/acs.jpcc.9b08090","article-title":"Interaction of graphene quantum dots with oligothiophene: a comprehensive theoretical study","volume":"123","author":"Ashraf","year":"2019","journal-title":"J. Phys. Chem. C"},{"key":"10.1016\/j.chemosphere.2023.139351_bib6","doi-asserted-by":"crossref","first-page":"7968","DOI":"10.1021\/ja00260a006","article-title":"Properties of atoms in molecules: atomic volumes","volume":"109","author":"Bader","year":"1987","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.chemosphere.2023.139351_bib7","doi-asserted-by":"crossref","first-page":"5648","DOI":"10.1063\/1.464913","article-title":"Density-functional thermochemistry. III. The role of exact exchange","volume":"98","author":"Beeke","year":"1993","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib8","doi-asserted-by":"crossref","first-page":"2360","DOI":"10.1021\/ic991316e","article-title":"Experimental electron density analysis of Mn2 (CO) 10: metal- metal and metal-Ligand bond characterization","volume":"39","author":"Bianchi","year":"2000","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib9","doi-asserted-by":"crossref","first-page":"8557","DOI":"10.1039\/D0CP03258A","article-title":"Electronic structure of polypyrrole composited with a low percentage of graphene nanofiller","volume":"23","author":"Chaughtai","year":"2021","journal-title":"Phys. Chem. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib10","doi-asserted-by":"crossref","DOI":"10.1142\/S021797921744074X","article-title":"Formaldehyde adsorption on carbon nanotubes fragment by density functional theory","volume":"31","author":"Chen","year":"2017","journal-title":"Int. J. Mod. Phys. B"},{"key":"10.1016\/j.chemosphere.2023.139351_bib11","doi-asserted-by":"crossref","DOI":"10.1016\/j.jlumin.2020.117198","article-title":"Intermolecular weak interactions of crystalline purine and uric acid investigated by terahertz spectroscopy and theoretical calculation","volume":"223","author":"Chen","year":"2020","journal-title":"J. Lumin."},{"key":"10.1016\/j.chemosphere.2023.139351_bib12","doi-asserted-by":"crossref","first-page":"1085","DOI":"10.1016\/j.commatsci.2009.05.017","article-title":"Adsorption of formaldehyde molecule on the intrinsic and Al-doped graphene: a first principle study","volume":"46","author":"Chi","year":"2009","journal-title":"Comput. Mater. Sci."},{"key":"10.1016\/j.chemosphere.2023.139351_bib13","doi-asserted-by":"crossref","first-page":"106","DOI":"10.1039\/C7AN01051F","article-title":"Ab initio characterization and experimental validation on the roles of oxygen-containing groups in graphene based formaldehyde sensors","volume":"143","author":"Duan","year":"2018","journal-title":"Analyst"},{"key":"10.1016\/j.chemosphere.2023.139351_bib14","doi-asserted-by":"crossref","first-page":"2868","DOI":"10.1002\/jcc.26068","article-title":"Exploring nature and predicting strength of hydrogen bonds: a correlation analysis between atoms\u2010in\u2010molecules descriptors, binding energies, and energy components of symmetry\u2010adapted perturbation theory","volume":"40","author":"Emamian","year":"2019","journal-title":"J. Comput. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib15","doi-asserted-by":"crossref","first-page":"5529","DOI":"10.1063\/1.1501133","article-title":"From weak to strong interactions: a comprehensive analysis of the topological and energetic properties of the electron density distribution involving X-H\u00b7\u00b7\u00b7F-Y systems","volume":"117","author":"Espinosa","year":"2002","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib16","doi-asserted-by":"crossref","DOI":"10.1016\/j.eurpolymj.2020.109981","article-title":"Graphene-polyaniline composite as superior electrochemical sensor for detection of cyano explosives","volume":"138","author":"Farooqi","year":"2020","journal-title":"Eur. Polym. J."},{"key":"10.1016\/j.chemosphere.2023.139351_bib17","doi-asserted-by":"crossref","first-page":"1801","DOI":"10.1016\/j.jece.2017.03.011","article-title":"Preparation of activated carbon from bamboo-cellulose fiber and its use for EDLC electrode material","volume":"5","author":"Fujishige","year":"2017","journal-title":"J. Environ. Chem. Eng."},{"key":"10.1016\/j.chemosphere.2023.139351_bib18","doi-asserted-by":"crossref","first-page":"436","DOI":"10.1016\/j.jhazmat.2018.08.029","article-title":"Effects of oxygen functional complexes on arsenic adsorption over carbonaceous surface","volume":"360","author":"Gao","year":"2018","journal-title":"J. Hazard Mater."},{"key":"10.1016\/j.chemosphere.2023.139351_bib19","doi-asserted-by":"crossref","DOI":"10.1063\/1.3382344","article-title":"A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu","volume":"132","author":"Grimme","year":"2010","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib20","doi-asserted-by":"crossref","first-page":"1585","DOI":"10.1016\/0008-6223(95)00120-3","article-title":"Study of oxygen-containing groups in a series of graphite oxides: physical and chemical characterization","volume":"33","author":"Hontoria-Lucas","year":"1995","journal-title":"Carbon"},{"key":"10.1016\/j.chemosphere.2023.139351_bib21","doi-asserted-by":"crossref","first-page":"36","DOI":"10.1016\/j.comptc.2017.03.004","article-title":"NO2 sensing properties of a borazine doped nanographene: a DFT study","volume":"1106","author":"Hosseinian","year":"2017","journal-title":"Comput. Theor. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib22","doi-asserted-by":"crossref","first-page":"28525","DOI":"10.1007\/s11356-018-2681-z","article-title":"Characterization and adsorption capacity of potassium permanganate used to modify activated carbon filter media for indoor formaldehyde removal","volume":"25","author":"Hu","year":"2018","journal-title":"Environ. Sci. Pollut. Res."},{"key":"10.1016\/j.chemosphere.2023.139351_bib23","doi-asserted-by":"crossref","first-page":"33","DOI":"10.1016\/0263-7855(96)00018-5","article-title":"VMD: visual molecular dynamics","volume":"14","author":"Humphrey","year":"1996","journal-title":"J. Mol. Graph."},{"key":"10.1016\/j.chemosphere.2023.139351_bib24","doi-asserted-by":"crossref","DOI":"10.1016\/j.molliq.2019.111902","article-title":"Silver clusters tune up electronic properties of graphene nanoflakes: a comprehensive theoretical study","volume":"297","author":"Jadoon","year":"2020","journal-title":"J. Mol. Liq."},{"key":"10.1016\/j.chemosphere.2023.139351_bib25","doi-asserted-by":"crossref","first-page":"166","DOI":"10.1016\/j.jpowsour.2016.01.062","article-title":"Comparative theoretical study of adsorption of lithium polysulfides (Li2Sx) on pristine and defective graphene","volume":"308","author":"Jand","year":"2016","journal-title":"J. Power Sources"},{"key":"10.1016\/j.chemosphere.2023.139351_bib26","doi-asserted-by":"crossref","DOI":"10.1063\/1.3700154","article-title":"A geometrical correction for the inter- and intra-molecular basis set superposition error in Hartree-Fock and density functional theory calculations for large systems","volume":"136","author":"Kruse","year":"2012","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib27","doi-asserted-by":"crossref","first-page":"312","DOI":"10.1002\/ajim.23093","article-title":"Occupational exposure to formaldehyde and risk of lung cancer: a systematic review and meta\u2010analysis","volume":"63","author":"Kwak","year":"2020","journal-title":"Am. J. Ind. Med."},{"key":"10.1016\/j.chemosphere.2023.139351_bib28","doi-asserted-by":"crossref","DOI":"10.1016\/j.chemosphere.2022.135776","article-title":"Promotion of formaldehyde degradation by electro-Fenton: controlling the distribution of \u00b7OH and formaldehyde near cathode to increase the reaction probability","volume":"307","author":"Lai","year":"2022","journal-title":"Chemosphere"},{"key":"10.1016\/j.chemosphere.2023.139351_bib29","doi-asserted-by":"crossref","first-page":"30895","DOI":"10.1039\/C7CP06900F","article-title":"Gas adsorption efficacy of graphene sheets functionalised with carboxyl, hydroxyl and epoxy groups in conjunction with Stone-Thrower-Wales (STW) and inverse Stone-Thrower-Wales (ISTW) defects","volume":"19","author":"Lalitha","year":"2017","journal-title":"Phys. Chem. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib30","doi-asserted-by":"crossref","first-page":"245","DOI":"10.1016\/j.molliq.2015.09.007","article-title":"Comparison of 2-amino benzyl alcohol adsorption onto activated carbon, silicon carbide nanoparticle and silicon carbide nanoparticle loaded on activated carbon","volume":"212","author":"Lemraski","year":"2015","journal-title":"J. Mol. Liq."},{"key":"10.1016\/j.chemosphere.2023.139351_bib31","doi-asserted-by":"crossref","first-page":"10865","DOI":"10.1021\/jp048562i","article-title":"Properties of the C\u2212H\u00b7\u00b7\u00b7H dihydrogen bond: an ab initio and topological analysis","volume":"108","author":"Lipkowski","year":"2004","journal-title":"J. Phys. Chem. C"},{"key":"10.1016\/j.chemosphere.2023.139351_bib32","doi-asserted-by":"crossref","DOI":"10.1016\/j.colsurfa.2022.128743","article-title":"Facile formation of Mo-vacancy defective MoS2\/CdS nanoparticles enhanced efficient hydrogen production","volume":"643","author":"Liu","year":"2022","journal-title":"Colloids Surf. A Physicochem. Eng. Asp."},{"key":"10.1016\/j.chemosphere.2023.139351_bib33","doi-asserted-by":"crossref","DOI":"10.1016\/j.apsusc.2020.145410","article-title":"Interaction between smithsonite and carboxyl collectors with different molecular structure in the presence of water: a theoretical and experimental study","volume":"510","author":"Liu","year":"2020","journal-title":"Appl. Surf. Sci."},{"key":"10.1016\/j.chemosphere.2023.139351_bib34","doi-asserted-by":"crossref","first-page":"580","DOI":"10.1002\/jcc.22885","article-title":"Multiwfn: a multifunctional wavefunction analyzer","volume":"33","author":"Lu","year":"2012","journal-title":"J. Comput. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib35","doi-asserted-by":"crossref","first-page":"1","DOI":"10.3866\/PKU.WHXB2012281","article-title":"Comparison of computational methods for atomic charges","volume":"28","author":"Lu","year":"2012","journal-title":"Acta Phys. Chim. Sin."},{"key":"10.1016\/j.chemosphere.2023.139351_bib36","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1007\/s00894-020-04577-0","article-title":"van der Waals potential: an important complement to molecular electrostatic potential in studying intermolecular interactions","volume":"26","author":"Lu","year":"2020","journal-title":"J. Mol. Model."},{"key":"10.1016\/j.chemosphere.2023.139351_bib37","doi-asserted-by":"crossref","first-page":"539","DOI":"10.1002\/jcc.26812","article-title":"Independent gradient model based on Hirshfeld partition: a new method for visual study of interactions in chemical systems","volume":"43","author":"Lu","year":"2022","journal-title":"J. Comput. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib38","doi-asserted-by":"crossref","first-page":"148","DOI":"10.4028\/www.scientific.net\/JNanoR.48.148","article-title":"Possibility of improving oscillation performance of double-walled nanotube oscillators via tuning vacancy defects","volume":"48","author":"Luo","year":"2017","journal-title":"J. Nano Res."},{"key":"10.1016\/j.chemosphere.2023.139351_bib39","first-page":"5045","article-title":"Selective reduction of oxygen functional groups to improve the response characteristics of graphene oxide-based formaldehyde sensor device: a first principle study","volume":"65","author":"Manna","year":"2018","journal-title":"IEEE Trans. Electron. Dev."},{"key":"10.1016\/j.chemosphere.2023.139351_bib40","doi-asserted-by":"crossref","first-page":"388","DOI":"10.1136\/oem.52.6.388","article-title":"Asthmatic symptoms and volatile organic compounds, formaldehyde, and carbon dioxide in dwellings","volume":"52","author":"Norb\u00e4ck","year":"1995","journal-title":"Occup. Environ. Med."},{"key":"10.1016\/j.chemosphere.2023.139351_bib41","doi-asserted-by":"crossref","DOI":"10.1016\/j.mssp.2022.106753","article-title":"Electrochemical sensing of heptazine graphitic C3N4 quantum dot for chemical warfare agents; a quantum chemical approach","volume":"148","author":"Qureshi","year":"2022","journal-title":"Mater. Sci. Semicond. Process."},{"key":"10.1016\/j.chemosphere.2023.139351_bib42","doi-asserted-by":"crossref","first-page":"235","DOI":"10.1016\/j.apsusc.2013.09.053","article-title":"Surface modification of bone char for removal of formaldehyde from air","volume":"286","author":"Rezaee","year":"2013","journal-title":"Appl. Surf. Sci."},{"key":"10.1016\/j.chemosphere.2023.139351_bib43","doi-asserted-by":"crossref","first-page":"55227","DOI":"10.1039\/C5RA08141F","article-title":"An exceptional functionalization of doped fullerene observed via theoretical studies on the interactions of sulfur-doped fullerenes with halogens and halides","volume":"5","author":"Saadat","year":"2015","journal-title":"RSC Adv."},{"key":"10.1016\/j.chemosphere.2023.139351_bib44","doi-asserted-by":"crossref","first-page":"739","DOI":"10.1007\/s11224-015-0616-6","article-title":"Study of noncovalent interactions of end-caped sulfur-doped carbon nanotubes using DFT, QTAIM, NBO and NCI calculations","volume":"27","author":"Saadat","year":"2016","journal-title":"Struct. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib45","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1186\/s12995-014-0043-4","article-title":"Sinonasal adenoid cystic carcinoma following formaldehyde exposure in the operating theatre","volume":"9","author":"Sandvik","year":"2014","journal-title":"J. Occup. Med. Toxicol."},{"key":"10.1016\/j.chemosphere.2023.139351_bib46","article-title":"Low temperature CO oxidation in sintering flue gas over Cu-Ce\/AC catalysts: effect of pretreatment with KMnO4 on activity","volume":"1\u201312","author":"Shen","year":"2022","journal-title":"Catal. Lett."},{"key":"10.1016\/j.chemosphere.2023.139351_bib47","doi-asserted-by":"crossref","DOI":"10.1016\/j.ijleo.2021.166555","article-title":"Effect of vacancy defects on photoelectric properties of K2CsSb photocathode","volume":"232","author":"Shu","year":"2021","journal-title":"Optik"},{"key":"10.1016\/j.chemosphere.2023.139351_bib48","doi-asserted-by":"crossref","first-page":"8440","DOI":"10.1039\/C5RA26600A","article-title":"Alkoxycarbonylation of \u03b1, \u03b2-unsaturated amides catalyzed by palladium (ii) complexes: a DFT study of the mechanism","volume":"6","author":"Suleiman","year":"2016","journal-title":"RSC Adv."},{"key":"10.1016\/j.chemosphere.2023.139351_bib49","doi-asserted-by":"crossref","first-page":"2363","DOI":"10.3390\/app9112363","article-title":"The impacts of random distributed vacancy defects in steady-state thermal conduction of graphene","volume":"9","author":"Sun","year":"2019","journal-title":"Appl. Sci."},{"key":"10.1016\/j.chemosphere.2023.139351_bib50","doi-asserted-by":"crossref","first-page":"207","DOI":"10.1016\/j.carbon.2018.05.023","article-title":"Removal of formaldehyde on carbon-based materials: a review of the recent approaches and findings","volume":"137","author":"Suresh","year":"2018","journal-title":"Carbon"},{"key":"10.1016\/j.chemosphere.2023.139351_bib51","doi-asserted-by":"crossref","first-page":"113","DOI":"10.1016\/j.compositesb.2016.08.016","article-title":"Mechanical properties of carbon nanotubes based polymer composites","volume":"103","author":"Tarfaoui","year":"2016","journal-title":"Composites, Part B"},{"key":"10.1016\/j.chemosphere.2023.139351_bib52","doi-asserted-by":"crossref","first-page":"151","DOI":"10.1007\/s11224-014-0476-5","article-title":"Adsorption of molecular iodine on the surface of sulfur-doped carbon nanotubes: theoretical study on their interactions, sensor properties, and other applications","volume":"26","author":"Tavakol","year":"2015","journal-title":"Struct. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib53","doi-asserted-by":"crossref","first-page":"50","DOI":"10.1016\/j.apcata.2017.05.001","article-title":"Fischer-Tropsch synthesis to light olefins over iron-based catalysts supported on KMnO4 modified activated carbon by a facile method","volume":"541","author":"Tian","year":"2017","journal-title":"Appl. Catal. A-gen."},{"issue":"2020","key":"10.1016\/j.chemosphere.2023.139351_bib55","doi-asserted-by":"crossref","first-page":"2098","DOI":"10.1007\/s11431-019-1504-7","article-title":"Experimental and theoretical studies on the removal mechanism of formaldehyde from water by mesoporous calcium silicate","volume":"63","author":"Wang","year":"2020","journal-title":"Sci. China Technol. Sci."},{"key":"10.1016\/j.chemosphere.2023.139351_bib56","doi-asserted-by":"crossref","first-page":"1142","DOI":"10.1080\/08927022.2017.1355551","article-title":"Biomethane storage in activated carbons: a grand canonical Monte Carlo simulation study","volume":"43","author":"Wang","year":"2017","journal-title":"Mol. Simulat."},{"key":"10.1016\/j.chemosphere.2023.139351_bib54","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1007\/s00894-017-3429-2","article-title":"The adsorption of NO, NH3, N2 on carbon surface: a density functional theory study","volume":"23","author":"Wang","year":"2017","journal-title":"J. Mol. Model."},{"key":"10.1016\/j.chemosphere.2023.139351_bib57","doi-asserted-by":"crossref","first-page":"3297","DOI":"10.1039\/b508541a","article-title":"Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: design and assessment of accuracy","volume":"7","author":"Weigend","year":"2005","journal-title":"Phys. Chem. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib58","doi-asserted-by":"crossref","DOI":"10.1016\/j.jece.2021.105987","article-title":"The effect of oxygen-containing functional groups on formaldehyde adsorption in solution on carbon surface: a density functional theory study","volume":"9","author":"Yang","year":"2021","journal-title":"J. Environ. Chem. Eng."},{"key":"10.1016\/j.chemosphere.2023.139351_bib59","doi-asserted-by":"crossref","DOI":"10.1088\/2053-1591\/aaabca","article-title":"Dy adsorption and penetration on defected graphene by first-principles calculations","volume":"5","author":"Yu","year":"2018","journal-title":"Mater. Res. Express"},{"key":"10.1016\/j.chemosphere.2023.139351_bib60","doi-asserted-by":"crossref","first-page":"310","DOI":"10.1016\/j.jclepro.2017.04.022","article-title":"Fast and efficient oxidation of formaldehyde in wastewater via the solar thermal electrochemical process tuned by thermo-electrochemistry","volume":"156","author":"Yuan","year":"2017","journal-title":"J. Clean. Prod."},{"key":"10.1016\/j.chemosphere.2023.139351_bib61","doi-asserted-by":"crossref","first-page":"2979","DOI":"10.1080\/03067319.2020.1762872","article-title":"Adsorption of formaldehyde from aqueous solution using activated carbon prepared from Hibiscus rosa-sinensis","volume":"13","author":"Zahed","year":"2022","journal-title":"Int. J. Environ. Anal. Chem."},{"key":"10.1016\/j.chemosphere.2023.139351_bib62","doi-asserted-by":"crossref","first-page":"13623","DOI":"10.1039\/D1CP01194D","article-title":"The interaction between vacancy defects in gallium sulfide monolayer and a new vacancy defect model","volume":"23","author":"Zhang","year":"2021","journal-title":"Phys. Chem. Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib63","doi-asserted-by":"crossref","first-page":"1147","DOI":"10.1007\/s11705-020-1978-x","article-title":"Insight into the effect of surface carboxyl and amino groups on the adsorption of titanium dioxide for acid red G","volume":"15","author":"Zhang","year":"2021","journal-title":"Front. Chem. Sci. Eng."},{"key":"10.1016\/j.chemosphere.2023.139351_bib64","doi-asserted-by":"crossref","first-page":"7347","DOI":"10.1166\/jnn.2010.2929","article-title":"Effects of Stone-Wales defect on the interactions between NH3, NO2 and graphene","volume":"10","author":"Zhang","year":"2010","journal-title":"J. Nanosci. Nanotechnol."},{"key":"10.1016\/j.chemosphere.2023.139351_bib65","doi-asserted-by":"crossref","DOI":"10.1016\/j.scitotenv.2022.160772","article-title":"Effect of oxygen functional groups on competitive adsorption of benzene and water on carbon materials: density functional theory study","volume":"863","author":"Zhao","year":"2023","journal-title":"Sci. Total Environ."},{"key":"10.1016\/j.chemosphere.2023.139351_bib66","doi-asserted-by":"crossref","first-page":"3713","DOI":"10.1039\/C6RA25396B","article-title":"Facile synthesis of MOFs with uncoordinated carboxyl groups for selective CO2 capture via postsynthetic covalent modification","volume":"7","author":"Zhou","year":"2017","journal-title":"RSC Adv."},{"key":"10.1016\/j.chemosphere.2023.139351_bib67","doi-asserted-by":"crossref","first-page":"770","DOI":"10.1007\/s12613-015-1133-8","article-title":"Role of the surface chemistry of activated carbons in dye removal from aqueous solution","volume":"22","author":"Zhou","year":"2015","journal-title":"Int. J. Miner. Metall. Mater."},{"key":"10.1016\/j.chemosphere.2023.139351_bib68","doi-asserted-by":"crossref","first-page":"80","DOI":"10.1016\/j.chemphys.2014.06.016","article-title":"DFT study of formaldehyde adsorption on vacancy defected graphene doped with B, N, and S","volume":"440","author":"Zhou","year":"2014","journal-title":"Chem. Phys."},{"key":"10.1016\/j.chemosphere.2023.139351_bib69","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.apr.2020.09.015","article-title":"Efficient adsorption of trace formaldehyde by polyaniline\/TiO2 composite at room temperature and mechanism investigation","volume":"12","author":"Zhu","year":"2021","journal-title":"Atmos. Pollut. Res."}],"container-title":["Chemosphere"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0045653523016181?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0045653523016181?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,9,23]],"date-time":"2025-09-23T13:16:18Z","timestamp":1758633378000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0045653523016181"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,10]]},"references-count":69,"alternative-id":["S0045653523016181"],"URL":"https:\/\/doi.org\/10.1016\/j.chemosphere.2023.139351","relation":{},"ISSN":["0045-6535"],"issn-type":[{"value":"0045-6535","type":"print"}],"subject":[],"published":{"date-parts":[[2023,10]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Synergistic mechanism of formaldehyde adsorption by intrinsic defects and carboxyl groups on the surface of carbon materials","name":"articletitle","label":"Article Title"},{"value":"Chemosphere","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.chemosphere.2023.139351","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2023 Elsevier Ltd. All rights reserved.","name":"copyright","label":"Copyright"}],"article-number":"139351"}}