{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T22:06:56Z","timestamp":1782943616726,"version":"3.54.5"},"reference-count":97,"publisher":"Royal Society of Chemistry (RSC)","issue":"39","license":[{"start":{"date-parts":[[2023,9,26]],"date-time":"2023-09-26T00:00:00Z","timestamp":1695686400000},"content-version":"vor","delay-in-days":268,"URL":"http:\/\/creativecommons.org\/licenses\/by-nc\/3.0\/"}],"funder":[{"DOI":"10.13039\/100010661","name":"Horizon 2020 Framework Programme","doi-asserted-by":"publisher","award":["865657"],"award-info":[{"award-number":["865657"]}],"id":[{"id":"10.13039\/100010661","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004837","name":"Ministerio de Ciencia e Innovaci\u00f3n","doi-asserted-by":"publisher","award":["PID2021-126427NBI00"],"award-info":[{"award-number":["PID2021-126427NBI00"]}],"id":[{"id":"10.13039\/501100004837","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["rsc.org"],"crossmark-restriction":true},"short-container-title":["Phys. Chem. Chem. Phys."],"abstract":"<jats:p>HCN\/forsterite interactions are present in many environments of the interstellar medium, leading to both molecular and dissociative HCN adsorptions, by means of its catalytic surface sites.<\/jats:p>","DOI":"10.1039\/d3cp01459b","type":"journal-article","created":{"date-parts":[[2023,9,26]],"date-time":"2023-09-26T02:04:13Z","timestamp":1695693853000},"page":"26797-26812","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":14,"title":["Adsorption of HCN on cosmic silicates: a periodic quantum mechanical study"],"prefix":"10.1039","volume":"25","author":[{"given":"Niccol\u00f2","family":"Bancone","sequence":"first","affiliation":[{"name":"Dipartimento di Chimica and NIS \u2013 Nanostructured Interfaces and Surfaces \u2013 Centre, Universit\u00e0 degli Studi di Torino, via P. Giuria 7, 10125, Torino, Italy"},{"name":"Departament de Qu\u00edmica, Universitat Aut\u00f2noma de Barcelona, 08193 Bellaterra, Spain"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-2457-1065","authenticated-orcid":false,"given":"Stefano","family":"Pantaleone","sequence":"additional","affiliation":[{"name":"Dipartimento di Chimica and NIS \u2013 Nanostructured Interfaces and Surfaces \u2013 Centre, Universit\u00e0 degli Studi di Torino, via P. Giuria 7, 10125, Torino, Italy"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8886-9832","authenticated-orcid":false,"given":"Piero","family":"Ugliengo","sequence":"additional","affiliation":[{"name":"Dipartimento di Chimica and NIS \u2013 Nanostructured Interfaces and Surfaces \u2013 Centre, Universit\u00e0 degli Studi di Torino, via P. Giuria 7, 10125, Torino, Italy"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-9637-4554","authenticated-orcid":false,"given":"Albert","family":"Rimola","sequence":"additional","affiliation":[{"name":"Departament de Qu\u00edmica, Universitat Aut\u00f2noma de Barcelona, 08193 Bellaterra, Spain"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7248-2705","authenticated-orcid":false,"given":"Marta","family":"Corno","sequence":"additional","affiliation":[{"name":"Dipartimento di Chimica and NIS \u2013 Nanostructured Interfaces and Surfaces \u2013 Centre, Universit\u00e0 degli Studi di Torino, via P. Giuria 7, 10125, Torino, Italy"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"292","published-online":{"date-parts":[[2023]]},"reference":[{"key":"D3CP01459B\/cit1\/1","doi-asserted-by":"crossref","first-page":"L63","DOI":"10.1086\/320493","volume":"553","author":"Boonman","year":"2001","journal-title":"Astrophys. J."},{"key":"D3CP01459B\/cit2\/1","doi-asserted-by":"crossref","first-page":"146","DOI":"10.1016\/j.asr.2005.03.115","volume":"36","author":"Huang","year":"2005","journal-title":"Adv. Space Res."},{"key":"D3CP01459B\/cit3\/1","doi-asserted-by":"crossref","first-page":"156","DOI":"10.3847\/1538-4357\/aadfdb","volume":"866","author":"Rice","year":"2018","journal-title":"Astrophys. J."},{"key":"D3CP01459B\/cit4\/1","doi-asserted-by":"crossref","first-page":"50","DOI":"10.1093\/mnras\/stz2430","volume":"490","author":"Drozdovskaya","year":"2019","journal-title":"Mon. Not. R. Astron. Soc."},{"key":"D3CP01459B\/cit5\/1","first-page":"L55","volume":"317","author":"Dutrey","year":"1997","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit6\/1","doi-asserted-by":"crossref","first-page":"955","DOI":"10.1051\/0004-6361:200400026","volume":"425","author":"Thi","year":"2004","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit7\/1","doi-asserted-by":"crossref","first-page":"25","DOI":"10.3847\/1538-4357\/ab141e","volume":"876","author":"Bergner","year":"2019","journal-title":"Astrophys. J."},{"key":"D3CP01459B\/cit8\/1","doi-asserted-by":"crossref","first-page":"6","DOI":"10.3847\/1538-4365\/ac1440","volume":"257","author":"Guzm\u00e1n","year":"2021","journal-title":"Astrophys. J., Suppl. Ser."},{"key":"D3CP01459B\/cit9\/1","doi-asserted-by":"crossref","first-page":"A72","DOI":"10.1051\/0004-6361\/201527482","volume":"588","author":"Wirstr\u00f6m","year":"2016","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit10\/1","doi-asserted-by":"crossref","first-page":"580","DOI":"10.1016\/0019-1035(74)90023-2","volume":"23","author":"Huebner","year":"1974","journal-title":"Icarus"},{"key":"D3CP01459B\/cit11\/1","doi-asserted-by":"crossref","first-page":"L27","DOI":"10.1088\/2041-8205\/754\/2\/L27","volume":"754","author":"Pizzarello","year":"2012","journal-title":"Astrophys. J."},{"key":"D3CP01459B\/cit12\/1","doi-asserted-by":"crossref","first-page":"43","DOI":"10.1016\/0019-1035(90)90102-F","volume":"85","author":"Tanguy","year":"1990","journal-title":"Icarus"},{"key":"D3CP01459B\/cit13\/1","doi-asserted-by":"crossref","first-page":"A88","DOI":"10.1051\/0004-6361\/202141422","volume":"658","author":"Rengel","year":"2022","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit14\/1","doi-asserted-by":"crossref","first-page":"65","DOI":"10.1038\/nature13789","volume":"514","author":"de Kok","year":"2014","journal-title":"Nature"},{"key":"D3CP01459B\/cit15\/1","doi-asserted-by":"crossref","first-page":"576","DOI":"10.1051\/0004-6361:20010260","volume":"370","author":"Liszt","year":"2001","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit16\/1","doi-asserted-by":"crossref","first-page":"717","DOI":"10.1086\/306032","volume":"503","author":"Hirota","year":"1998","journal-title":"Astrophys. J."},{"key":"D3CP01459B\/cit17\/1","doi-asserted-by":"crossref","first-page":"1193","DOI":"10.1038\/1911193a0","volume":"191","author":"Or\u00f3","year":"1961","journal-title":"Nature"},{"key":"D3CP01459B\/cit18\/1","first-page":"214","volume":"30","author":"Martins","year":"2009","journal-title":"Origins Life Evol. Biospheres"},{"key":"D3CP01459B\/cit19\/1","volume-title":"ESLAB Symposium on the Exploration of Halley's Comet","volume":"250","author":"Matthews","year":"1986","unstructured":"C. N.Matthews  and  R.Ludicky ,  ESLAB Symposium on the Exploration of Halley's Comet ,  1986 ,  vol. 250"},{"key":"D3CP01459B\/cit20\/1","doi-asserted-by":"crossref","first-page":"345","DOI":"10.1016\/0019-1035(91)90233-J","volume":"94","author":"Cruikshank","year":"1991","journal-title":"Icarus"},{"key":"D3CP01459B\/cit21\/1","doi-asserted-by":"crossref","first-page":"281","DOI":"10.1007\/BF00926899","volume":"12","author":"Matthews","year":"1982","journal-title":"Origins Life"},{"key":"D3CP01459B\/cit22\/1","doi-asserted-by":"crossref","first-page":"1365","DOI":"10.1016\/0032-0633(95)00023-X","volume":"43","author":"Matthews","year":"1995","journal-title":"Planet. Space Sci."},{"key":"D3CP01459B\/cit23\/1","first-page":"223","volume":"30","author":"Sanchez","year":"1967","journal-title":"J. Mol. Biol."},{"key":"D3CP01459B\/cit24\/1","doi-asserted-by":"crossref","first-page":"24","DOI":"10.1016\/j.cplett.2012.04.042","volume":"538","author":"Yim","year":"2012","journal-title":"Chem. Phys. Lett."},{"key":"D3CP01459B\/cit25\/1","doi-asserted-by":"crossref","first-page":"465","DOI":"10.1089\/ast.2013.0973","volume":"13","author":"Jung","year":"2013","journal-title":"Astrobiology"},{"key":"D3CP01459B\/cit26\/1","doi-asserted-by":"crossref","first-page":"21469","DOI":"10.1021\/jp505978p","volume":"118","author":"F\u00e1bi\u00e1n","year":"2014","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit27\/1","doi-asserted-by":"crossref","first-page":"2152","DOI":"10.1021\/acsearthspacechem.1c00195","volume":"5","author":"Sandstrom","year":"2021","journal-title":"ACS Earth Space Chem."},{"key":"D3CP01459B\/cit28\/1","doi-asserted-by":"crossref","first-page":"1531","DOI":"10.1002\/bkcs.11324","volume":"38","author":"Choe","year":"2017","journal-title":"Bull. Korean Chem. Soc."},{"key":"D3CP01459B\/cit29\/1","doi-asserted-by":"crossref","first-page":"53","DOI":"10.1016\/S0166-1280(99)00356-5","volume":"507","author":"Kikuchi","year":"2000","journal-title":"THEOCHEM"},{"key":"D3CP01459B\/cit30\/1","doi-asserted-by":"crossref","first-page":"611","DOI":"10.1051\/0004-6361:20010126","volume":"369","author":"Smith","year":"2001","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit31\/1","doi-asserted-by":"crossref","first-page":"7224","DOI":"10.1039\/D1CP05407D","volume":"24","author":"Santalucia","year":"2022","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D3CP01459B\/cit32\/1","doi-asserted-by":"crossref","first-page":"205","DOI":"10.1002\/bkcs.11666","volume":"40","author":"Choe","year":"2019","journal-title":"Bull. Korean Chem. Soc."},{"key":"D3CP01459B\/cit33\/1","doi-asserted-by":"crossref","first-page":"345","DOI":"10.1021\/acsearthspacechem.9b00271","volume":"4","author":"Signorile","year":"2020","journal-title":"ACS Earth Space Chem."},{"key":"D3CP01459B\/cit34\/1","doi-asserted-by":"crossref","first-page":"21","DOI":"10.1146\/annurev-astro-081309-130815","volume":"48","author":"Henning","year":"2010","journal-title":"Annu. Rev. Astron. Astrophys."},{"key":"D3CP01459B\/cit35\/1","doi-asserted-by":"crossref","first-page":"255","DOI":"10.1146\/annurev.ea.21.050193.001351","volume":"21","author":"Buseck","year":"1993","journal-title":"Annu. Rev. Earth Planet. Sci."},{"key":"D3CP01459B\/cit36\/1","first-page":"509","volume":"325","author":"Delsemme","year":"1988","journal-title":"Philos. Trans. R. Soc., A"},{"key":"D3CP01459B\/cit37\/1","doi-asserted-by":"crossref","first-page":"20","DOI":"10.1016\/j.pepi.2008.04.001","volume":"172","author":"Walker","year":"2009","journal-title":"Phys. Earth Planet. Inter."},{"key":"D3CP01459B\/cit38\/1","doi-asserted-by":"crossref","first-page":"87","DOI":"10.1007\/s00269-008-0260-4","volume":"36","author":"Ottonello","year":"2009","journal-title":"Phys. Chem. Miner."},{"key":"D3CP01459B\/cit39\/1","doi-asserted-by":"crossref","first-page":"5866","DOI":"10.1021\/jp4118198","volume":"118","author":"Navarro-Ruiz","year":"2014","journal-title":"J. Phys. Chem. A"},{"key":"D3CP01459B\/cit40\/1","doi-asserted-by":"crossref","first-page":"2498","DOI":"10.1021\/jp409837d","volume":"118","author":"Bruno","year":"2014","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit41\/1","doi-asserted-by":"crossref","first-page":"1439","DOI":"10.1002\/jcc.23941","volume":"36","author":"Demichelis","year":"2015","journal-title":"J. Comput. Chem."},{"key":"D3CP01459B\/cit42\/1","doi-asserted-by":"crossref","first-page":"17447","DOI":"10.1039\/C4CP00819G","volume":"16","author":"Navarro-Ruiz","year":"2014","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D3CP01459B\/cit43\/1","doi-asserted-by":"crossref","first-page":"914","DOI":"10.1093\/mnras\/stv1628","volume":"453","author":"Navarro-Ruiz","year":"2015","journal-title":"Mon. Not. R. Astron. Soc."},{"key":"D3CP01459B\/cit44\/1","doi-asserted-by":"crossref","first-page":"12612","DOI":"10.1021\/jp4025365","volume":"117","author":"Garcia-Gil","year":"2013","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit45\/1","doi-asserted-by":"crossref","first-page":"389","DOI":"10.1093\/mnras\/stx1965","volume":"472","author":"Suhasaria","year":"2017","journal-title":"Mon. Not. R. Astron. Soc."},{"key":"D3CP01459B\/cit46\/1","doi-asserted-by":"crossref","first-page":"5389","DOI":"10.1093\/mnras\/sty3024","volume":"482","author":"Molpeceres","year":"2019","journal-title":"Mon. Not. R. Astron. Soc."},{"key":"D3CP01459B\/cit47\/1","doi-asserted-by":"crossref","first-page":"1050","DOI":"10.1021\/acsearthspacechem.0c00084","volume":"4","author":"Liu","year":"2020","journal-title":"ACS Earth Space Chem."},{"key":"D3CP01459B\/cit48\/1","doi-asserted-by":"crossref","first-page":"29091","DOI":"10.1021\/jp504187y","volume":"118","author":"Smith","year":"2014","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit49\/1","doi-asserted-by":"crossref","first-page":"11","DOI":"10.1016\/j.epsl.2010.10.019","volume":"300","author":"King","year":"2010","journal-title":"Earth Planet. Sci. Lett."},{"key":"D3CP01459B\/cit50\/1","doi-asserted-by":"crossref","first-page":"5431","DOI":"10.1039\/b816905e","volume":"11","author":"Goumans","year":"2009","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D3CP01459B\/cit51\/1","doi-asserted-by":"crossref","first-page":"332","DOI":"10.1007\/s002690050262","volume":"27","author":"de Leeuw","year":"2000","journal-title":"Phys. Chem. Miner."},{"key":"D3CP01459B\/cit52\/1","doi-asserted-by":"crossref","first-page":"400","DOI":"10.1016\/j.icarus.2008.07.017","volume":"198","author":"Muralidharan","year":"2008","journal-title":"Icarus"},{"key":"D3CP01459B\/cit53\/1","doi-asserted-by":"crossref","first-page":"384","DOI":"10.1021\/acsearthspacechem.7b00041","volume":"1","author":"Zamirri","year":"2017","journal-title":"ACS Earth Space Chem."},{"key":"D3CP01459B\/cit54\/1","doi-asserted-by":"crossref","first-page":"064702","DOI":"10.1063\/1.5075632","volume":"150","author":"Zamirri","year":"2019","journal-title":"J. Chem. Phys."},{"key":"D3CP01459B\/cit55\/1","doi-asserted-by":"crossref","first-page":"18217","DOI":"10.1039\/C7CP03504G","volume":"19","author":"Rimola","year":"2017","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D3CP01459B\/cit56\/1","doi-asserted-by":"crossref","first-page":"355","DOI":"10.1016\/j.epsl.2014.10.029","volume":"408","author":"Asaduzzaman","year":"2014","journal-title":"Earth Planet. Sci. Lett."},{"key":"D3CP01459B\/cit57\/1","doi-asserted-by":"crossref","first-page":"3554","DOI":"10.1021\/jp4105147","volume":"118","author":"Escamilla-Roa","year":"2014","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit58\/1","doi-asserted-by":"crossref","first-page":"3317","DOI":"10.1093\/mnras\/stv2197","volume":"454","author":"Suhasaria","year":"2015","journal-title":"Mon. Not. R. Astron. Soc."},{"key":"D3CP01459B\/cit59\/1","doi-asserted-by":"crossref","first-page":"A63","DOI":"10.1051\/0004-6361\/202037587","volume":"636","author":"Corazzi","year":"2020","journal-title":"Astron. Astrophys."},{"key":"D3CP01459B\/cit60\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.pss.2012.06.007","volume":"70","author":"Escamilla-Roa","year":"2012","journal-title":"Planet. Space Sci."},{"key":"D3CP01459B\/cit61\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.pss.2012.10.017","volume":"75","author":"Escamilla-Roa","year":"2013","journal-title":"Planet. Space Sci."},{"key":"D3CP01459B\/cit62\/1","doi-asserted-by":"crossref","first-page":"26080","DOI":"10.1021\/jp507650w","volume":"118","author":"Escamilla-Roa","year":"2014","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit63\/1","doi-asserted-by":"crossref","first-page":"L213","DOI":"10.1086\/319640","volume":"550","author":"Li","year":"2001","journal-title":"Astrophys. J."},{"key":"D3CP01459B\/cit64\/1","first-page":"e1360","volume":"8","author":"Dovesi","year":"2018","journal-title":"Wiley Interdiscip. Rev.: Comput. Mol. Sci."},{"key":"D3CP01459B\/cit65\/1","doi-asserted-by":"crossref","first-page":"3865","DOI":"10.1103\/PhysRevLett.77.3865","volume":"77","author":"Perdew","year":"1996","journal-title":"Phys. Rev. Lett."},{"key":"D3CP01459B\/cit66\/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":"D3CP01459B\/cit67\/1","doi-asserted-by":"crossref","first-page":"5244","DOI":"10.1021\/acs.jctc.0c00149","volume":"16","author":"Cutini","year":"2020","journal-title":"J. Chem. Theory Comput."},{"key":"D3CP01459B\/cit68\/1","doi-asserted-by":"crossref","first-page":"405","DOI":"10.1039\/B715018K","volume":"10","author":"Civalleri","year":"2008","journal-title":"CrystEngComm"},{"key":"D3CP01459B\/cit69\/1","doi-asserted-by":"crossref","first-page":"2571","DOI":"10.1063\/1.463096","volume":"97","author":"Sch\u00e4fer","year":"1992","journal-title":"J. Chem. Phys."},{"key":"D3CP01459B\/cit70\/1","doi-asserted-by":"crossref","first-page":"76","DOI":"10.1093\/imamat\/6.1.76","volume":"6","author":"Broyden","year":"1970","journal-title":"IMA J. Appl. Math."},{"key":"D3CP01459B\/cit71\/1","doi-asserted-by":"crossref","first-page":"317","DOI":"10.1093\/comjnl\/13.3.317","volume":"13","author":"Fletcher","year":"1970","journal-title":"Comput. J."},{"key":"D3CP01459B\/cit72\/1","doi-asserted-by":"crossref","first-page":"23","DOI":"10.1090\/S0025-5718-1970-0258249-6","volume":"24","author":"Goldfarb","year":"1970","journal-title":"Math. Comput."},{"key":"D3CP01459B\/cit73\/1","doi-asserted-by":"crossref","first-page":"647","DOI":"10.1090\/S0025-5718-1970-0274029-X","volume":"24","author":"Shanno","year":"1970","journal-title":"Math. Comput."},{"key":"D3CP01459B\/cit74\/1","first-page":"1","volume-title":"Encyclopedia of Nanotechnology","author":"Corno","year":"2015","unstructured":"M.Corno  and  P.Ugliengo ,  Surface modeling of ceramic biomaterials , in  Encyclopedia of Nanotechnology , ed.  B. Bhushan ,  Springer Science + Business Media ,  2015 ,  pp. 1\u201313"},{"key":"D3CP01459B\/cit75\/1","doi-asserted-by":"crossref","first-page":"140","DOI":"10.1016\/0009-2614(69)80118-1","volume":"3","author":"Jansen","year":"1969","journal-title":"Chem. Phys. Lett."},{"key":"D3CP01459B\/cit76\/1","doi-asserted-by":"crossref","first-page":"4557","DOI":"10.1063\/1.1680654","volume":"59","author":"Liu","year":"1973","journal-title":"J. Chem. Phys."},{"key":"D3CP01459B\/cit77\/1","doi-asserted-by":"crossref","first-page":"553","DOI":"10.1080\/00268977000101561","volume":"19","author":"Boys","year":"1970","journal-title":"Mol. Phys."},{"key":"D3CP01459B\/cit78\/1","first-page":"1","author":"Williams","year":"2003","journal-title":"Solid State Astrochem."},{"key":"D3CP01459B\/cit79\/1","volume-title":"Handbook of Vibrational Spectroscopy","author":"Nakamoto","year":"2006","unstructured":"K.Nakamoto ,  Handbook of Vibrational Spectroscopy ,  John Wiley & Sons, Ltd ,  2006"},{"key":"D3CP01459B\/cit80\/1","doi-asserted-by":"crossref","first-page":"2989","DOI":"10.1021\/jp9088244","volume":"114","author":"Zicovich-Wilson","year":"2010","journal-title":"J. Phys. Chem. C"},{"key":"D3CP01459B\/cit81\/1","doi-asserted-by":"crossref","first-page":"894","DOI":"10.1021\/j150489a013","volume":"55","author":"Marcus","year":"1951","journal-title":"J. Phys. Chem."},{"key":"D3CP01459B\/cit82\/1","doi-asserted-by":"crossref","first-page":"359","DOI":"10.1063\/1.1700424","volume":"20","author":"Marcus","year":"1952","journal-title":"J. Chem. Phys."},{"key":"D3CP01459B\/cit83\/1","doi-asserted-by":"crossref","first-page":"667","DOI":"10.1073\/pnas.38.8.667","volume":"38","author":"Rosenstock","year":"1952","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"D3CP01459B\/cit84\/1","doi-asserted-by":"crossref","DOI":"10.1093\/oso\/9780195074949.001.0001","volume-title":"Unimolecular Reaction Dynamics: Theory and Experiments","author":"Baer","year":"1996","unstructured":"T.Baer  and  W. L.Hase ,  Unimolecular Reaction Dynamics: Theory and Experiments ,  Oxford University Press ,  USA ,  1996"},{"key":"D3CP01459B\/cit85\/1","doi-asserted-by":"crossref","first-page":"1303","DOI":"10.1103\/PhysRev.35.1303","volume":"35","author":"Eckart","year":"1930","journal-title":"Phys. Rev."},{"key":"D3CP01459B\/cit86\/1","doi-asserted-by":"crossref","first-page":"532","DOI":"10.1021\/j100809a040","volume":"66","author":"Johnston","year":"1962","journal-title":"J. Phys. Chem."},{"key":"D3CP01459B\/cit87\/1","first-page":"588","volume":"58","author":"Smyth","year":"1973","journal-title":"Am. Mineral. J. Earth Planet. Mater."},{"key":"D3CP01459B\/cit88\/1","doi-asserted-by":"crossref","first-page":"70","DOI":"10.1007\/s002690050088","volume":"25","author":"Watson","year":"1997","journal-title":"Phys. Chem. Miner."},{"key":"D3CP01459B\/cit89\/1","first-page":"965","volume":"72","author":"Bostroem","year":"1987","journal-title":"Am. Mineral."},{"key":"D3CP01459B\/cit90\/1","doi-asserted-by":"crossref","first-page":"1775","DOI":"10.1002\/jcc.21750","volume":"32","author":"De La Pierre","year":"2011","journal-title":"J. Comput. Chem."},{"key":"D3CP01459B\/cit91\/1","doi-asserted-by":"crossref","first-page":"4977","DOI":"10.1088\/0022-3719\/12\/22\/036","volume":"12","author":"Tasker","year":"1979","journal-title":"J. Phys. C-Solid State Phys."},{"key":"D3CP01459B\/cit92\/1","doi-asserted-by":"crossref","first-page":"449","DOI":"10.1524\/zkri.1901.34.1.449","volume":"34","author":"Wulff","year":"1901","journal-title":"Z. Kristallogr. - Cryst. Mater."},{"key":"D3CP01459B\/cit93\/1","first-page":"767","volume-title":"Protostars and Planets V","author":"Natta","year":"2007","unstructured":"A.Natta ,  L.Testi ,  N.Calvet ,  T.Henning ,  R.Waters  and  D.Wilner , in  Protostars and Planets V , ed.  D. Jewitt  and  K. Keil ,  University of Arizona Press ,  Tucson ,  2007 ,  pp. 767\u2013781"},{"key":"D3CP01459B\/cit94\/1","doi-asserted-by":"crossref","first-page":"2323","DOI":"10.1021\/acsearthspacechem.9b00157","volume":"3","author":"Zamirri","year":"2019","journal-title":"ACS Earth Space Chem."},{"key":"D3CP01459B\/cit95\/1","doi-asserted-by":"crossref","first-page":"344","DOI":"10.1016\/0039-6028(91)90691-K","volume":"255","author":"Pacchioni","year":"1991","journal-title":"Surf. Sci."},{"key":"D3CP01459B\/cit96\/1","doi-asserted-by":"crossref","first-page":"159","DOI":"10.1016\/0039-6028(95)01057-2","volume":"350","author":"Pacchioni","year":"1996","journal-title":"Surf. Sci."},{"key":"D3CP01459B\/cit97\/1","doi-asserted-by":"crossref","first-page":"7694","DOI":"10.1021\/jp2017049","volume":"115","author":"Mino","year":"2011","journal-title":"J. Phys. Chem. C"}],"container-title":["Physical Chemistry Chemical Physics"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.rsc.org\/en\/content\/articlepdf\/2023\/CP\/D3CP01459B","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T21:34:05Z","timestamp":1782941645000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.rsc.org\/cp\/article\/25\/39\/26797-26812\/801191"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023]]},"references-count":97,"journal-issue":{"issue":"39","published-print":{"date-parts":[[2023,10,11]]}},"URL":"https:\/\/doi.org\/10.1039\/d3cp01459b","relation":{},"ISSN":["1463-9076","1463-9084"],"issn-type":[{"value":"1463-9076","type":"print"},{"value":"1463-9084","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023]]}}}