{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,4]],"date-time":"2026-07-04T10:16:37Z","timestamp":1783160197677,"version":"3.54.6"},"reference-count":56,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"funder":[{"DOI":"10.13039\/501100007446","name":"King Khalid University","doi-asserted-by":"publisher","award":["RGP2\/448\/46"],"award-info":[{"award-number":["RGP2\/448\/46"]}],"id":[{"id":"10.13039\/501100007446","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Journal of Molecular Graphics and Modelling"],"published-print":{"date-parts":[[2026,7]]},"DOI":"10.1016\/j.jmgm.2026.109448","type":"journal-article","created":{"date-parts":[[2026,5,16]],"date-time":"2026-05-16T15:32:17Z","timestamp":1778945537000},"page":"109448","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":1,"special_numbering":"C","title":["Understanding the synergistic role of Ni\/Pt doping and \u03b3-Al2O3 support in tuning CO2 adsorption and activation on Cu13 nanoclusters"],"prefix":"10.1016","volume":"146","author":[{"given":"Qamar","family":"Abuhassan","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Husni","family":"Farah","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"O.S.","family":"Waleed","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Maharshikumar B.","family":"Shukla","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Anupam","family":"Agarwal","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Abrorjon","family":"Hoshimov","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Zukhra","family":"Atamuratova","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Dilshod","family":"Raupov","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohammed K.","family":"Al Mesfer","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohd","family":"Danish","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mumtaj","family":"Shah","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.jmgm.2026.109448_bib1","doi-asserted-by":"crossref","DOI":"10.1016\/j.synthmet.2025.117952","article-title":"Advanced MnNi-P\/ZIF8@CNT electrocatalyst for CO2 reduction: Achieving high efficiency, stability, and low energy demand","volume":"315","author":"Karki","year":"2025","journal-title":"Synthetic Metals"},{"key":"10.1016\/j.jmgm.2026.109448_bib2","article-title":"Visible-light-driven Z-scheme Cs2TiBr6\u2013CaIn2S4 nanocomposites: Interfacial charge transfer, band alignment, and dual photocatalytic activity toward CO2 conversion and degradation of PFAS compounds","volume":"14","author":"Yang","year":"2026","journal-title":"Journal of Environmental Chemical Engineering"},{"key":"10.1016\/j.jmgm.2026.109448_bib3","doi-asserted-by":"crossref","DOI":"10.1016\/j.diamond.2026.113609","article-title":"Effect of different pore-forming agents on textural properties of walnut shell-derived extruded activated carbon for semi-industrial CO2 capture and contaminants adsorption","volume":"165","author":"Sawaran Singh","year":"2026","journal-title":"Diamond and Related Materials"},{"key":"10.1016\/j.jmgm.2026.109448_bib4","doi-asserted-by":"crossref","first-page":"3703","DOI":"10.1039\/c1cs15008a","volume":"40","author":"Wang","year":"2011","journal-title":"Chem. Soc. Rev."},{"key":"10.1016\/j.jmgm.2026.109448_bib5","doi-asserted-by":"crossref","first-page":"7833","DOI":"10.1039\/c2ee21586a","volume":"5","author":"Goeppert","year":"2012","journal-title":"Energy Environ. Sci."},{"key":"10.1016\/j.jmgm.2026.109448_bib6","doi-asserted-by":"crossref","first-page":"39","DOI":"10.1016\/j.synthmet.2018.04.003","article-title":"Fe\/Nx clusters embedded in graphene with tunable properties for gas separation","volume":"241","author":"Mohajeri","year":"2018","journal-title":"Synth. Met."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib7","doi-asserted-by":"crossref","first-page":"26","DOI":"10.1016\/j.ijoes.2023.01.005","article-title":"Application of electrochemically assisted \u200esynthesis of MOFs-derived phosphides as catalyst for CH4-CO2 reforming","volume":"18","author":"Guo","year":"2023","journal-title":"International \u200eJournal of Electrochemical Science"},{"key":"10.1016\/j.jmgm.2026.109448_bib8","article-title":"An in-depth theoretical exploration of metalloborospherene-based sensors for selective CO2 capture from gas mixtures","volume":"16","author":"Omidvar","year":"2025","journal-title":"Comput. Theor. Chem."},{"key":"10.1016\/j.jmgm.2026.109448_bib9","doi-asserted-by":"crossref","DOI":"10.1016\/j.molliq.2023.122048","article-title":"CO2 capture with green ionic liquid and deep eutectic solvent: a comparative study","volume":"383","author":"Ghaed-Sharaf","year":"2023","journal-title":"J. Mol. Liq."},{"key":"10.1016\/j.jmgm.2026.109448_bib10","doi-asserted-by":"crossref","first-page":"1719","DOI":"10.1126\/science.1090228","article-title":"Modern global climate change","volume":"302","author":"Karl","year":"2003","journal-title":"Science"},{"key":"10.1016\/j.jmgm.2026.109448_bib11","doi-asserted-by":"crossref","first-page":"12551","DOI":"10.1002\/anie.201105481","article-title":"Carbon dioxide hydrogenation to formic acid by using a heterogeneous gold catalyst","volume":"50","author":"Preti","year":"2011","journal-title":"Angew. Chem., Int. Ed."},{"key":"10.1016\/j.jmgm.2026.109448_bib12","doi-asserted-by":"crossref","first-page":"893","DOI":"10.1126\/science.1219831","article-title":"The active site of methanol synthesis over Cu\/ZnO\/Al2O3 industrial catalysts","volume":"336","author":"Behrens","year":"2012","journal-title":"Science"},{"key":"10.1016\/j.jmgm.2026.109448_bib13","doi-asserted-by":"crossref","first-page":"117","DOI":"10.1016\/j.susc.2017.10.032","article-title":"Charge-controlled switchable CO adsorption on FeN4 cluster embedded in graphene","volume":"668","author":"Omidvar","year":"2018","journal-title":"Surf. Sci."},{"key":"10.1016\/j.jmgm.2026.109448_bib14","series-title":"Carbon Dioxide as Chemical Feedstock","year":"2010"},{"key":"10.1016\/j.jmgm.2026.109448_bib15","doi-asserted-by":"crossref","DOI":"10.1016\/j.carbon.2025.121033","article-title":"Ru Nanocluster\u2013Mediated \u200eelectronic modulation of NiFe-LDH for enhanced electrocatalytic water splitting","volume":"247","author":"Li","year":"2026","journal-title":"Carbon"},{"key":"10.1016\/j.jmgm.2026.109448_bib16","doi-asserted-by":"crossref","first-page":"12551","DOI":"10.1002\/anie.201105481","volume":"50","author":"Preti","year":"2011","journal-title":"Angew. Chem., Int. Ed."},{"key":"10.1016\/j.jmgm.2026.109448_bib17","doi-asserted-by":"crossref","first-page":"11205","DOI":"10.1021\/acscatal.4c02341","volume":"14","author":"Bi","year":"2024","journal-title":"ACS Catal."},{"key":"10.1016\/j.jmgm.2026.109448_bib18","doi-asserted-by":"crossref","first-page":"938","DOI":"10.1038\/s41467-024-45096-3","volume":"15","author":"Abdellah","year":"2024","journal-title":"Nat. Commun."},{"key":"10.1016\/j.jmgm.2026.109448_bib19","doi-asserted-by":"crossref","first-page":"7984","DOI":"10.1021\/acs.chemrev.9b00723","volume":"120","author":"Jiang","year":"2020","journal-title":"Chem. Rev."},{"issue":"7","key":"10.1016\/j.jmgm.2026.109448_bib20","doi-asserted-by":"crossref","first-page":"4501","DOI":"10.1021\/acscatal.6b00822","article-title":"CO2 activatio\u01f9 on Ni\/\u03b3\u2212Al2O3 catalysts by first-principles calculations: from ideal surfaces to supported nanoparticles","volume":"6","author":"Silaghi","year":"2016","journal-title":"ACS Catal."},{"key":"10.1016\/j.jmgm.2026.109448_bib21","doi-asserted-by":"crossref","first-page":"3127","DOI":"10.1016\/j.tsf.2010.01.018","article-title":"Synthesis and catalytic properties of metal nanoparticles: size, shape, support, composition, and oxidation state effects","volume":"518","author":"Cuenya","year":"2010","journal-title":"Thin Solid Films"},{"issue":"10","key":"10.1016\/j.jmgm.2026.109448_bib22","doi-asserted-by":"crossref","first-page":"8219","DOI":"10.1021\/acscatal.5c00981","article-title":"Toward an Active \u200eSite\u2013Performance Relationship for Oxide-Supported Single and Few Atoms","volume":"\u200e\u200e15","author":"Liao","year":"2025","journal-title":"ACS Catalysis"},{"issue":"36","key":"10.1016\/j.jmgm.2026.109448_bib23","doi-asserted-by":"crossref","first-page":"32548","DOI":"10.1021\/jacs.5c06550","article-title":"Determination of Mn \u200eValence States in Nanocatalysts During Sustainable Syngas Conversion","volume":"147","author":"Li","year":"2025","journal-title":"Journal of the \u200eAmerican Chemical Society"},{"key":"10.1016\/j.jmgm.2026.109448_bib24","doi-asserted-by":"crossref","first-page":"4405","DOI":"10.1021\/acsomega.1c06208","article-title":"Theoretical study on carbon monoxide adsorption on unsupported and \u03b3-Al2O3-Supported silver nanoparticles: size, shape, and support effects","volume":"7","author":"Sawabe","year":"2022","journal-title":"ACS Omega"},{"key":"10.1016\/j.jmgm.2026.109448_bib25","doi-asserted-by":"crossref","first-page":"1290","DOI":"10.1002\/cctc.201100122","article-title":"Self-regenerative silver nanocluster catalyst for CO oxidation","volume":"3","author":"Shimizu","year":"2011","journal-title":"ChemCatChem"},{"key":"10.1016\/j.jmgm.2026.109448_bib26","doi-asserted-by":"crossref","first-page":"150","DOI":"10.1016\/j.cattod.2016.05.033","article-title":"The effect of support pretreatment on activity of Ag\/SiO2 catalysts in low-temperature CO oxidation","volume":"278","author":"Dutov","year":"2016","journal-title":"Catal. Today"},{"key":"10.1016\/j.jmgm.2026.109448_bib27","doi-asserted-by":"crossref","first-page":"452","DOI":"10.1007\/s12274-021-3501-1","article-title":"Nano-sized Ag rather than single-atom Ag determines CO oxidation activity and stability","volume":"15","author":"Wang","year":"2022","journal-title":"Nano Res."},{"key":"10.1016\/j.jmgm.2026.109448_bib28","doi-asserted-by":"crossref","DOI":"10.1016\/j.cplett.2024.141588","article-title":"Hydrogen evolution reaction on Ag12M icosahedrons: a DFT study","volume":"856","author":"Rodr\u00edguez-Kessler","year":"2024","journal-title":"Chem. Phys. Lett."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib29","doi-asserted-by":"crossref","first-page":"46","DOI":"10.1038\/s41524-021-00514-8","article-title":"Computational high-throughput screening of alloy nanoclusters for electrocatalytic hydrogen evolution","volume":"7","author":"Mao","year":"2021","journal-title":"npj Comput. Mater."},{"issue":"10","key":"10.1016\/j.jmgm.2026.109448_bib30","doi-asserted-by":"crossref","first-page":"2561","DOI":"10.1021\/acs.jpclett.5c00101","article-title":"Ligand-toMetal charge transfer controls the photophysical properties and HER activity of Ag13 nanoclusters depends on the hydrogen adsorption energy","volume":"16","author":"Devi","year":"2025","journal-title":"J. Phys. Chem. Lett."},{"key":"10.1016\/j.jmgm.2026.109448_bib31","doi-asserted-by":"crossref","first-page":"21583","DOI":"10.1021\/acsanm.5c04047","article-title":"Density functional theory studies of size and doping effects on hydrogen evolution catalysis by Ag and Cu nanoclusters","volume":"8","author":"Zahoor","year":"2025","journal-title":"ACS Appl. Nano Mater."},{"key":"10.1016\/j.jmgm.2026.109448_bib32","doi-asserted-by":"crossref","DOI":"10.1016\/j.commatsci.2025.114346","article-title":"Stability of single-atom Pt-alloyed cu clusters supported on \u03b3-Al2O3: a DFT study of size and oxidizing environment effects","volume":"262","author":"Shahrokhi","year":"2026","journal-title":"Comput. Mater. Sci."},{"issue":"18","key":"10.1016\/j.jmgm.2026.109448_bib33","doi-asserted-by":"crossref","DOI":"10.1002\/cctc.202400565","article-title":"DFT atomic\u2010scale insight into Pt\/Cu single atom alloy clusters supported on \u03b3\u2010Al2O3: the effect of hydrogen environment","volume":"16","author":"Shahrokhi","year":"2024","journal-title":"ChemCatChem"},{"issue":"2","key":"10.1016\/j.jmgm.2026.109448_bib34","doi-asserted-by":"crossref","first-page":"1270","DOI":"10.1021\/acsomega.9b03845","article-title":"Role of intermediate dynamics in controlling hydrogenation selectivity by heterogeneous catalysis","volume":"5","author":"Shahrokhi","year":"2020","journal-title":"ACS Omega"},{"issue":"18","key":"10.1016\/j.jmgm.2026.109448_bib35","doi-asserted-by":"crossref","first-page":"3865","DOI":"10.1103\/PhysRevLett.77.3865","article-title":"Generalized gradient approximation made simple","volume":"77","author":"Perdew","year":"1996","journal-title":"Phys. Rev. Lett."},{"key":"10.1016\/j.jmgm.2026.109448_bib36","series-title":"Gaussian 09, Revision A.01","author":"Frisch","year":"2009"},{"issue":"15","key":"10.1016\/j.jmgm.2026.109448_bib37","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.jmgm.2026.109448_bib38","doi-asserted-by":"crossref","DOI":"10.1039\/D5CP02714D","article-title":"Carbon support curvature modulates CO2 activation on molybdenum carbide clusters","volume":"27","author":"Cao","year":"2025","journal-title":"Phys. Chem. Chem. Phys."},{"key":"10.1016\/j.jmgm.2026.109448_bib39","doi-asserted-by":"crossref","first-page":"449","DOI":"10.1002\/ijch.199300051","article-title":"Combining synchronous transit and quasi-newton methods to find transition states","volume":"33","author":"Peng","year":"1993","journal-title":"Isr. J. Chem."},{"key":"10.1016\/j.jmgm.2026.109448_bib40","doi-asserted-by":"crossref","first-page":"735","DOI":"10.1063\/1.449486","article-title":"Natural population analysis","volume":"83","author":"Reed","year":"1985","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.jmgm.2026.109448_bib41","doi-asserted-by":"crossref","first-page":"2776","DOI":"10.1021\/cs500248a","article-title":"Nature of Ag species on Ag\/\u03b3-Al2O3: a combined experimental and theoretical study","volume":"4","author":"Deng","year":"2014","journal-title":"ACS Catal."},{"key":"10.1016\/j.jmgm.2026.109448_bib42","doi-asserted-by":"crossref","first-page":"885","DOI":"10.1021\/jp102530y","article-title":"New insights into the active surface species of silver alumina catalysts in the selective catalytic reduction of NO","volume":"115","author":"Korhonen","year":"2011","journal-title":"J. Phys. Chem. C"},{"key":"10.1016\/j.jmgm.2026.109448_bib43","doi-asserted-by":"crossref","first-page":"950","DOI":"10.1021\/jp066147f","article-title":"Reductive activation of O2 with H2-Reduced silver clusters as a key step in the H2-Promoted selective catalytic reduction of NO with C3H8 over Ag\/Al2O3","volume":"111","author":"Shimizu","year":"2007","journal-title":"J. Phys. Chem. C"},{"key":"10.1016\/j.jmgm.2026.109448_bib44","doi-asserted-by":"crossref","first-page":"4805","DOI":"10.1021\/jp050253k","article-title":"Structural investigation of the promotional effect of hydrogen during the selective catalytic reduction of NOx with hydrocarbons over Ag\/Al2O3 catalysts","volume":"109","author":"Breen","year":"2005","journal-title":"J. Phys. Chem. B"},{"key":"10.1016\/j.jmgm.2026.109448_bib45","doi-asserted-by":"crossref","first-page":"79","DOI":"10.1016\/j.jcat.2005.09.036","article-title":"The role of Ag-O-Al species in silver-alumina catalysts for the selective catalytic reduction of NOx with methane","volume":"237","author":"She","year":"2006","journal-title":"J. Catal."},{"key":"10.1016\/j.jmgm.2026.109448_bib46","doi-asserted-by":"crossref","first-page":"7996","DOI":"10.1021\/jp5000792","article-title":"Cooperative H2 activation at Ag Cluster\/\u03b8-Al2O3(110) dual perimeter sites: a density functional theory study","volume":"118","author":"Hirunsit","year":"2014","journal-title":"J. Phys. Chem. C"},{"issue":"19","key":"10.1016\/j.jmgm.2026.109448_bib47","doi-asserted-by":"crossref","first-page":"8577","DOI":"10.1063\/1.470117","article-title":"A smooth particle mesh ewald method","volume":"103","author":"Essmann","year":"1995","journal-title":"J. Chem. Phys."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib48","doi-asserted-by":"crossref","first-page":"54","DOI":"10.1016\/j.jcat.2004.04.020","article-title":"Use of DFT to achieve a rational understanding of acid\u2013basic properties of \u03b3-alumina surfaces","volume":"226","author":"Digne","year":"2004","journal-title":"J. Catal."},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib49","doi-asserted-by":"crossref","DOI":"10.1002\/cctc.202401300","article-title":"Effect of oxidized tin interfacial atoms on methylcyclohexane dehydrogenation catalyzed by \u03b3\u2010Alumina supported platinum clusters","volume":"17","author":"Shahrokhi","year":"2025","journal-title":"ChemCatChem"},{"issue":"23","key":"10.1016\/j.jmgm.2026.109448_bib50","doi-asserted-by":"crossref","DOI":"10.1002\/cctc.202201089","article-title":"Stability of Pt10Sn3 clusters supported on \u03b3\u2010Al2O3 in oxidizing environment: a DFT comparison of alloying and size effects","volume":"14","author":"Shahrokhi","year":"2022","journal-title":"ChemCatChem"},{"issue":"5","key":"10.1016\/j.jmgm.2026.109448_bib51","article-title":"Toward high\u2010efficiency photovoltaics\u2010assisted electrochemical and photoelectrochemical CO2 reduction: strategy and challenge","volume":"3","author":"Cho","year":"2023","journal-title":"InExploration"},{"issue":"5","key":"10.1016\/j.jmgm.2026.109448_bib52","article-title":"Achievements and challenges of copper\u2010based single\u2010atom catalysts for the reduction of carbon dioxide to C2+ products","volume":"3","author":"Tang","year":"2023","journal-title":"InExploration"},{"issue":"2","key":"10.1016\/j.jmgm.2026.109448_bib53","article-title":"Interplaying coordination and ligand effects to break or make adsorption\u2010energy scaling relations","volume":"2","author":"Brito\u2010Ravicini","year":"2022","journal-title":"InExploration"},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib54","doi-asserted-by":"crossref","DOI":"10.1016\/j.bgtech.2023.100002","article-title":"Microbially induced carbonate precipitation (MICP) for soil strengthening: a comprehensive review","volume":"1","author":"Fu","year":"2023","journal-title":"Biogeotechnics"},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib55","doi-asserted-by":"crossref","DOI":"10.1016\/j.bgtech.2023.100004","article-title":"Inorganic ionic polymerization: a bioinspired strategy for material preparation","volume":"1","author":"Zhang","year":"2023","journal-title":"Biogeotechnics"},{"issue":"1","key":"10.1016\/j.jmgm.2026.109448_bib56","doi-asserted-by":"crossref","DOI":"10.1016\/j.bgtech.2023.100008","article-title":"Applications of microbial-induced carbonate precipitation: a state-of-the-art review","volume":"1","author":"Wang","year":"2023","journal-title":"Biogeotechnics"}],"container-title":["Journal of Molecular Graphics and Modelling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S1093326326001749?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S1093326326001749?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2026,7,4]],"date-time":"2026-07-04T09:27:42Z","timestamp":1783157262000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S1093326326001749"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,7]]},"references-count":56,"alternative-id":["S1093326326001749"],"URL":"https:\/\/doi.org\/10.1016\/j.jmgm.2026.109448","relation":{},"ISSN":["1093-3263"],"issn-type":[{"value":"1093-3263","type":"print"}],"subject":[],"published":{"date-parts":[[2026,7]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Understanding the synergistic role of Ni\/Pt doping and \u03b3-Al2O3 support in tuning CO2 adsorption and activation on Cu13 nanoclusters","name":"articletitle","label":"Article Title"},{"value":"Journal of Molecular Graphics and Modelling","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.jmgm.2026.109448","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2026 Elsevier Inc. All rights are reserved, including those for text and data mining, AI training, and similar technologies.","name":"copyright","label":"Copyright"}],"article-number":"109448"}}