{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T03:59:11Z","timestamp":1782878351019,"version":"3.54.5"},"reference-count":99,"publisher":"Royal Society of Chemistry (RSC)","issue":"21","license":[{"start":{"date-parts":[[2023,5,4]],"date-time":"2023-05-04T00:00:00Z","timestamp":1683158400000},"content-version":"am","delay-in-days":488,"URL":"http:\/\/rsc.li\/journals-terms-of-use"}],"funder":[{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["42120104007"],"award-info":[{"award-number":["42120104007"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["41775125"],"award-info":[{"award-number":["41775125"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["91961123"],"award-info":[{"award-number":["91961123"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004001","name":"Guizhou Science and Technology Department","doi-asserted-by":"publisher","award":["[2019]5648"],"award-info":[{"award-number":["[2019]5648"]}],"id":[{"id":"10.13039\/501100004001","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100010828","name":"Department of Education of Guizhou Province","doi-asserted-by":"publisher","award":["KY[2012]014"],"award-info":[{"award-number":["KY[2012]014"]}],"id":[{"id":"10.13039\/501100010828","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13038\/100006151","name":"Basic Energy Sciences","doi-asserted-by":"publisher","award":["DE-SC0015997"],"award-info":[{"award-number":["DE-SC0015997"]}],"id":[{"id":"10.13038\/100006151","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["rsc.org"],"crossmark-restriction":true},"short-container-title":["Phys. Chem. Chem. Phys."],"abstract":"<jats:p>We calculated the kinetics of the simplest atmospheric reaction of a Criegee intermediate with a ketone by using our recently developed dual-level variational transition state theory scheme with the beyond-CCSD(T) electronic structure method W3X-L.<\/jats:p>","DOI":"10.1039\/d2cp01118b","type":"journal-article","created":{"date-parts":[[2022,5,4]],"date-time":"2022-05-04T18:41:17Z","timestamp":1651689677000},"page":"13066-13073","update-policy":"https:\/\/doi.org\/10.1039\/rsc_crossmark_policy","source":"Crossref","is-referenced-by-count":27,"title":["Temperature-dependent kinetics of the atmospheric reaction between CH\n                    <sub>2<\/sub>\n                    OO and acetone"],"prefix":"10.1039","volume":"24","author":[{"given":"Peng-Biao","family":"Wang","sequence":"first","affiliation":[{"name":"Department of Physics, Guizhou University, Guiyang, 550025, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-7742-7294","authenticated-orcid":false,"given":"Donald G.","family":"Truhlar","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Chemical Theory Center, and Supercomputing Institute, University of Minnesota, Minneapolis, Minnesota 55455-0431, USA"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yu","family":"Xia","sequence":"additional","affiliation":[{"name":"College of Materials Science and Engineering, Guizhou Minzu University, Guiyang 550025, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-9358-2585","authenticated-orcid":false,"given":"Bo","family":"Long","sequence":"additional","affiliation":[{"name":"Department of Physics, Guizhou University, Guiyang, 550025, China"},{"name":"College of Materials Science and Engineering, Guizhou Minzu University, Guiyang 550025, China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"292","published-online":{"date-parts":[[2022]]},"reference":[{"key":"D2CP01118B\/cit1\/1","doi-asserted-by":"crossref","first-page":"745","DOI":"10.1002\/anie.197507451","volume":"14","author":"Criegee","year":"1975","journal-title":"Angew. Chem., Int. Ed. Engl."},{"key":"D2CP01118B\/cit2\/1","doi-asserted-by":"crossref","first-page":"349","DOI":"10.1080\/0144235X.2020.1782651","volume":"39","author":"Cabezas","year":"2020","journal-title":"Int. Rev. Phys. Chem."},{"key":"D2CP01118B\/cit3\/1","doi-asserted-by":"crossref","first-page":"383","DOI":"10.1080\/0144235X.2020.1792104","volume":"39","author":"Chhantyal-Pun","year":"2020","journal-title":"Int. Rev. Phys. Chem."},{"key":"D2CP01118B\/cit4\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1080\/0144235X.2020.1688530","volume":"39","author":"Stephenson","year":"2020","journal-title":"Int. Rev. Phys. Chem."},{"key":"D2CP01118B\/cit5\/1","doi-asserted-by":"crossref","first-page":"309","DOI":"10.1080\/0144235X.2015.1055676","volume":"34","author":"Osborn","year":"2015","journal-title":"Int. Rev. Phys. Chem."},{"key":"D2CP01118B\/cit6\/1","doi-asserted-by":"crossref","first-page":"34131","DOI":"10.1029\/2001JD000597","volume":"106","author":"Hasson","year":"2001","journal-title":"J. Geophys. Res."},{"key":"D2CP01118B\/cit7\/1","doi-asserted-by":"crossref","first-page":"183","DOI":"10.1146\/annurev-physchem-052516-050739","volume":"68","author":"Taatjes","year":"2017","journal-title":"Annu. Rev. Phys. Chem."},{"key":"D2CP01118B\/cit8\/1","doi-asserted-by":"crossref","first-page":"699","DOI":"10.1039\/b704260b","volume":"37","author":"Johnson","year":"2008","journal-title":"Chem. Soc. Rev."},{"key":"D2CP01118B\/cit9\/1","doi-asserted-by":"crossref","first-page":"154","DOI":"10.1126\/science.1236475","volume":"340","author":"Vereecken","year":"2013","journal-title":"Science"},{"key":"D2CP01118B\/cit10\/1","doi-asserted-by":"crossref","first-page":"1704","DOI":"10.1039\/c3cp52842a","volume":"16","author":"Taatjes","year":"2014","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit11\/1","doi-asserted-by":"crossref","first-page":"10848","DOI":"10.1039\/c0cp02564j","volume":"13","author":"Donahue","year":"2011","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit12\/1","doi-asserted-by":"crossref","first-page":"061102","DOI":"10.1063\/1.4941768","volume":"144","author":"Fang","year":"2016","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit13\/1","doi-asserted-by":"crossref","first-page":"044312","DOI":"10.1063\/1.4958992","volume":"145","author":"Fang","year":"2016","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit14\/1","doi-asserted-by":"crossref","first-page":"131102","DOI":"10.1063\/1.4964393","volume":"145","author":"Nguyen","year":"2016","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit15\/1","doi-asserted-by":"crossref","first-page":"234308","DOI":"10.1063\/1.4972015","volume":"145","author":"Fang","year":"2016","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit16\/1","doi-asserted-by":"crossref","first-page":"978","DOI":"10.1021\/acs.accounts.8b00077","volume":"51","author":"Lester","year":"2018","journal-title":"Acc. Chem. Res."},{"key":"D2CP01118B\/cit17\/1","doi-asserted-by":"crossref","first-page":"4929","DOI":"10.1021\/acs.jpca.0c02867","volume":"124","author":"Hansen","year":"2020","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit18\/1","doi-asserted-by":"crossref","first-page":"2559","DOI":"10.1021\/acs.jpca.8b12324","volume":"123","author":"Barber","year":"2019","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit19\/1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.5194\/amt-11-1-2018","volume":"11","author":"Rickly","year":"2018","journal-title":"Atmos. Meas. Tech."},{"key":"D2CP01118B\/cit20\/1","doi-asserted-by":"crossref","first-page":"19941","DOI":"10.1039\/C4CP02719A","volume":"16","author":"Novelli","year":"2014","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit21\/1","doi-asserted-by":"crossref","first-page":"24940","DOI":"10.1039\/C8CP05332D","volume":"20","author":"Stone","year":"2018","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit22\/1","doi-asserted-by":"crossref","first-page":"8518","DOI":"10.1039\/D0RA01406K","volume":"10","author":"Li","year":"2020","journal-title":"RSC Adv."},{"key":"D2CP01118B\/cit23\/1","doi-asserted-by":"crossref","first-page":"6428","DOI":"10.1039\/D1CP05877K","volume":"24","author":"Vereecken","year":"2022","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit24\/1","doi-asserted-by":"crossref","first-page":"10866","DOI":"10.1021\/jacs.8b06010","volume":"140","author":"Barber","year":"2018","journal-title":"J. Am. Chem. Soc."},{"key":"D2CP01118B\/cit25\/1","doi-asserted-by":"crossref","first-page":"509","DOI":"10.1038\/nchem.2488","volume":"8","author":"Kidwell","year":"2016","journal-title":"Nat. Chem."},{"key":"D2CP01118B\/cit26\/1","doi-asserted-by":"crossref","first-page":"12372","DOI":"10.1073\/pnas.1715014114","volume":"114","author":"Green","year":"2017","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"D2CP01118B\/cit27\/1","doi-asserted-by":"crossref","first-page":"1596","DOI":"10.1126\/science.1257158","volume":"345","author":"Liu","year":"2014","journal-title":"Science"},{"key":"D2CP01118B\/cit28\/1","doi-asserted-by":"crossref","first-page":"3245","DOI":"10.5194\/acp-16-3245-2016","volume":"16","author":"Zhao","year":"2016","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit29\/1","doi-asserted-by":"crossref","first-page":"4673","DOI":"10.5194\/acp-18-4673-2018","volume":"18","author":"Mackenzie-Rae","year":"2018","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit30\/1","doi-asserted-by":"crossref","first-page":"813","DOI":"10.5194\/acp-21-813-2021","volume":"21","author":"Gong","year":"2021","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit31\/1","doi-asserted-by":"crossref","first-page":"1743","DOI":"10.1021\/acsearthspacechem.0c00147","volume":"4","author":"Chhantyal-Pun","year":"2020","journal-title":"ACS Earth Space Chem."},{"key":"D2CP01118B\/cit32\/1","doi-asserted-by":"crossref","first-page":"172171","DOI":"10.1098\/rsos.172171","volume":"5","author":"Ma","year":"2018","journal-title":"R. Soc. open sci."},{"key":"D2CP01118B\/cit33\/1","doi-asserted-by":"crossref","first-page":"12500","DOI":"10.1039\/C5CP01171J","volume":"17","author":"Zhao","year":"2015","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit34\/1","doi-asserted-by":"crossref","first-page":"2869","DOI":"10.1021\/jp012713p","volume":"106","author":"Bonn","year":"2002","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit35\/1","doi-asserted-by":"crossref","first-page":"527","DOI":"10.1038\/nature18271","volume":"533","author":"Tr\u00f6stl","year":"2016","journal-title":"Nature"},{"key":"D2CP01118B\/cit36\/1","doi-asserted-by":"crossref","first-page":"1053","DOI":"10.5194\/acp-5-1053-2005","volume":"5","author":"Kanakidou","year":"2005","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit37\/1","doi-asserted-by":"crossref","first-page":"1109","DOI":"10.1126\/science.aad5456","volume":"352","author":"Bianchi","year":"2016","journal-title":"Science"},{"key":"D2CP01118B\/cit38\/1","doi-asserted-by":"crossref","first-page":"6095","DOI":"10.5194\/acp-18-6095-2018","volume":"18","author":"Newland","year":"2018","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit39\/1","doi-asserted-by":"crossref","first-page":"1245","DOI":"10.1021\/acs.est.8b05073","volume":"53","author":"Taatjes","year":"2019","journal-title":"Environ. Sci. Technol."},{"key":"D2CP01118B\/cit40\/1","doi-asserted-by":"crossref","first-page":"288","DOI":"10.1021\/acsearthspacechem.7b00044","volume":"1","author":"Meidan","year":"2017","journal-title":"ACS Earth Space Chem."},{"key":"D2CP01118B\/cit41\/1","doi-asserted-by":"crossref","first-page":"45","DOI":"10.1039\/c3fd00048f","volume":"165","author":"Percival","year":"2013","journal-title":"Faraday Discuss."},{"key":"D2CP01118B\/cit42\/1","doi-asserted-by":"crossref","first-page":"611","DOI":"10.1002\/kin.21101","volume":"49","author":"Khan","year":"2017","journal-title":"Int. J. Chem. Kinet."},{"key":"D2CP01118B\/cit43\/1","doi-asserted-by":"crossref","first-page":"193","DOI":"10.1038\/nature11278","volume":"488","author":"Mauldin III","year":"2012","journal-title":"Nature"},{"key":"D2CP01118B\/cit44\/1","doi-asserted-by":"crossref","first-page":"020901","DOI":"10.1063\/1.4923165","volume":"143","author":"Lee","year":"2015","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit45\/1","doi-asserted-by":"crossref","first-page":"477","DOI":"10.1038\/nchem.1890","volume":"6","author":"Su","year":"2014","journal-title":"Nat. Chem."},{"key":"D2CP01118B\/cit46\/1","doi-asserted-by":"crossref","first-page":"751","DOI":"10.1126\/science.1261549","volume":"347","author":"Chao","year":"2015","journal-title":"Science"},{"key":"D2CP01118B\/cit47\/1","doi-asserted-by":"crossref","first-page":"177","DOI":"10.1126\/science.1234689","volume":"340","author":"Taatjes","year":"2013","journal-title":"Science"},{"key":"D2CP01118B\/cit48\/1","doi-asserted-by":"crossref","first-page":"174","DOI":"10.1126\/science.1234369","volume":"340","author":"Su","year":"2013","journal-title":"Science"},{"key":"D2CP01118B\/cit49\/1","first-page":"437","volume":"20","author":"Khan","year":"2018","journal-title":"Environ. Sci.: Process. Impacts"},{"key":"D2CP01118B\/cit50\/1","doi-asserted-by":"crossref","first-page":"13497","DOI":"10.5194\/acp-20-13497-2020","volume":"20","author":"Cox","year":"2020","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit51\/1","doi-asserted-by":"crossref","first-page":"10391","DOI":"10.1039\/c2cp40294g","volume":"14","author":"Taatjes","year":"2012","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit52\/1","doi-asserted-by":"crossref","first-page":"474","DOI":"10.1002\/kin.21007","volume":"48","author":"Elsamra","year":"2016","journal-title":"Int. J. Chem. Kinet."},{"key":"D2CP01118B\/cit53\/1","doi-asserted-by":"crossref","first-page":"2363","DOI":"10.1021\/acsearthspacechem.9b00213","volume":"3","author":"Chhantyal-Pun","year":"2019","journal-title":"ACS Earth Space Chem."},{"key":"D2CP01118B\/cit54\/1","doi-asserted-by":"crossref","first-page":"19862","DOI":"10.1039\/C5CP02224J","volume":"17","author":"Berndt","year":"2015","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit55\/1","doi-asserted-by":"crossref","first-page":"8557","DOI":"10.1021\/acs.jpca.1c05280","volume":"125","author":"Cornwell","year":"2021","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit56\/1","doi-asserted-by":"crossref","first-page":"16841","DOI":"10.1039\/c3cp52598h","volume":"15","author":"Jalan","year":"2013","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit57\/1","doi-asserted-by":"crossref","first-page":"2822","DOI":"10.1063\/1.477924","volume":"110","author":"Montgomery, Jr.","year":"1999","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit58\/1","doi-asserted-by":"crossref","first-page":"6532","DOI":"10.1063\/1.481224","volume":"112","author":"Montgomery, Jr.","year":"2000","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit59\/1","doi-asserted-by":"crossref","first-page":"14409","DOI":"10.1021\/jacs.6b08655","volume":"138","author":"Long","year":"2016","journal-title":"J. Am. Chem. Soc."},{"key":"D2CP01118B\/cit60\/1","doi-asserted-by":"crossref","first-page":"6135","DOI":"10.1073\/pnas.1804453115","volume":"115","author":"Long","year":"2018","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"D2CP01118B\/cit61\/1","doi-asserted-by":"crossref","first-page":"8402","DOI":"10.1021\/jacs.1c02029","volume":"143","author":"Long","year":"2021","journal-title":"J. Am. Chem. Soc."},{"key":"D2CP01118B\/cit62\/1","doi-asserted-by":"crossref","first-page":"2003","DOI":"10.1038\/s41467-019-09948-7","volume":"10","author":"Long","year":"2019","journal-title":"Nat. Commun."},{"key":"D2CP01118B\/cit63\/1","doi-asserted-by":"crossref","first-page":"7479","DOI":"10.1039\/C7CP08582F","volume":"20","author":"Misiewicz","year":"2018","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit64\/1","doi-asserted-by":"crossref","first-page":"22555","DOI":"10.1039\/D0CP03781H","volume":"22","author":"Mull","year":"2020","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit65\/1","doi-asserted-by":"crossref","first-page":"17760","DOI":"10.1039\/C9CP03480C","volume":"21","author":"Aroeira","year":"2019","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit66\/1","doi-asserted-by":"crossref","first-page":"7701","DOI":"10.1039\/C7CP07312G","volume":"20","author":"Tan","year":"2018","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit67\/1","doi-asserted-by":"crossref","first-page":"611","DOI":"10.1021\/jacs.8b11766","volume":"141","author":"Long","year":"2019","journal-title":"J. Am. Chem. Soc."},{"key":"D2CP01118B\/cit68\/1","doi-asserted-by":"crossref","first-page":"8800","DOI":"10.1039\/C9CP06297A","volume":"22","author":"Tan","year":"2020","journal-title":"Phys. Chem. Chem. Phys."},{"key":"D2CP01118B\/cit69\/1","doi-asserted-by":"crossref","first-page":"114104","DOI":"10.1063\/1.5020436","volume":"148","author":"Gy\u0151rffy","year":"2018","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit70\/1","doi-asserted-by":"crossref","first-page":"094106","DOI":"10.1063\/1.4867135","volume":"140","author":"Parker","year":"2014","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit71\/1","doi-asserted-by":"crossref","first-page":"2109","DOI":"10.1021\/acs.jctc.5b00135","volume":"11","author":"Chan","year":"2015","journal-title":"J. Chem. Theory Comput."},{"key":"D2CP01118B\/cit72\/1","doi-asserted-by":"crossref","first-page":"1280","DOI":"10.1021\/acs.jctc.5b01082","volume":"12","author":"Yu","year":"2016","journal-title":"J. Chem. Theory Comput."},{"key":"D2CP01118B\/cit73\/1","doi-asserted-by":"crossref","first-page":"117","DOI":"10.1021\/jz201525m","volume":"3","author":"Peverati","year":"2012","journal-title":"J. Phys. Chem. Lett."},{"key":"D2CP01118B\/cit74\/1","doi-asserted-by":"crossref","first-page":"215","DOI":"10.1007\/s00214-007-0310-x","volume":"120","author":"Zhao","year":"2008","journal-title":"Theor. Chem. Acc."},{"key":"D2CP01118B\/cit75\/1","doi-asserted-by":"crossref","first-page":"1384","DOI":"10.1021\/jp021590l","volume":"107","author":"Lynch","year":"2003","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit76\/1","doi-asserted-by":"crossref","first-page":"2872","DOI":"10.1021\/ct100326h","volume":"6","author":"Alecu","year":"2010","journal-title":"J. Chem. Theory Comput."},{"key":"D2CP01118B\/cit77\/1","first-page":"242","volume":"2","author":"Werner","year":"2012","journal-title":"Wiley Interdiscip. Rev.: Comput. Mol. Sci."},{"key":"D2CP01118B\/cit79\/1","doi-asserted-by":"crossref","first-page":"074107","DOI":"10.1063\/1.5142048","volume":"152","author":"K\u00e1llay","year":"2020","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit80\/1","author":"K\u00e1llay","unstructured":"M.K\u00e1llay ,  P. R.Nagy ,  D.Mester ,  Z.Rolik ,  G.Samu ,  J.Csontos ,  J.Cs\u00f3ka ,  P. B.Szab\u00f3 ,  L.Gyevi-Nagy ,  B.H\u00e9gely ,  I.Ladj\u00e1nszki ,  L.Szegedy ,  B.Lad\u00f3czki ,  K.Petrov ,  M.Farkas ,  P. D.Mezei  and  A.Ganyecz , MRCC, A Quantum Chemical Program Suite.  www.mrcc.hu  (accessed 2020-02-22)"},{"key":"D2CP01118B\/cit81\/1","doi-asserted-by":"crossref","first-page":"1853","DOI":"10.1063\/1.443157","volume":"76","author":"Garrett","year":"1982","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit82\/1","first-page":"65","volume-title":"Generalized Transition State Theory. In Theory of Chemical ReactionDynamics","author":"Truhlar","year":"1985","unstructured":"D. G.Truhlar ,  A. D.Isacson  and  B. C.Garrett ,  Generalized Transition State Theory. In Theory of Chemical ReactionDynamics ,  CRC Press ,  Boca Raton ,  1985 , vol. 4,  pp. 65\u2013137"},{"key":"D2CP01118B\/cit83\/1","doi-asserted-by":"crossref","first-page":"7548","DOI":"10.1039\/C7CS00602K","volume":"46","author":"Bao","year":"2017","journal-title":"Chem. Soc. Rev."},{"key":"D2CP01118B\/cit84\/1","doi-asserted-by":"crossref","first-page":"5610","DOI":"10.1073\/pnas.1920018117","volume":"117","author":"Zhang","year":"2020","journal-title":"Proc. Natl. Acad. Sci. U. S. A."},{"key":"D2CP01118B\/cit85\/1","doi-asserted-by":"crossref","first-page":"59","DOI":"10.1039\/c2fd20012k","volume":"157","author":"Zheng","year":"2012","journal-title":"Faraday Discuss."},{"key":"D2CP01118B\/cit88\/1","doi-asserted-by":"crossref","first-page":"2690","DOI":"10.1021\/jacs.5b11938","volume":"138","author":"Bao","year":"2016","journal-title":"J. Am. Chem. Soc."},{"key":"D2CP01118B\/cit89\/1","doi-asserted-by":"crossref","first-page":"12146","DOI":"10.1021\/jp4060704","volume":"117","author":"Georgievskii","year":"2013","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit90\/1","doi-asserted-by":"crossref","first-page":"55","DOI":"10.1016\/S0069-8040(03)80004-3","volume":"39","author":"Klippenstein","year":"2003","journal-title":"Comprehensive Chem. Kinet."},{"key":"D2CP01118B\/cit91\/1","author":"Georgievskii","unstructured":"Y.Georgievskii  and  S. J.Klippenstein , MESS.  https:\/\/tcg.cse.anl.gov\/papr\/codes\/mess.html  (accessed May 1, 2019)"},{"key":"D2CP01118B\/cit92\/1","doi-asserted-by":"crossref","first-page":"269","DOI":"10.1016\/j.atmosenv.2015.04.056","volume":"112","author":"Khan","year":"2015","journal-title":"Atmos. Environ."},{"key":"D2CP01118B\/cit93\/1","doi-asserted-by":"crossref","first-page":"1805","DOI":"10.1029\/93JD00764","volume":"99","author":"Singh","year":"1994","journal-title":"J. Geophys. Res."},{"key":"D2CP01118B\/cit94\/1","doi-asserted-by":"crossref","first-page":"ACH 5-1","DOI":"10.1029\/2001JD000694","volume":"107","author":"Jacob","year":"2002","journal-title":"J. Geophys. Res."},{"key":"D2CP01118B\/cit95\/1","doi-asserted-by":"crossref","first-page":"2695","DOI":"10.1021\/jp993738f","volume":"104","author":"Wollenhaupt","year":"2000","journal-title":"J. Phys. Chem. A"},{"key":"D2CP01118B\/cit96\/1","doi-asserted-by":"crossref","first-page":"10600","DOI":"10.1063\/1.1619950","volume":"119","author":"Yamada","year":"2003","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit97\/1","doi-asserted-by":"crossref","first-page":"5050","DOI":"10.1021\/j100303a033","volume":"91","author":"Wellington","year":"1987","journal-title":"J. Chem. Phys."},{"key":"D2CP01118B\/cit98\/1","doi-asserted-by":"crossref","first-page":"3625","DOI":"10.5194\/acp-6-3625-2006","volume":"6","author":"Atkinson","year":"2006","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit99\/1","doi-asserted-by":"crossref","first-page":"7807","DOI":"10.5194\/acp-17-7807-2017","volume":"17","author":"Novelli","year":"2017","journal-title":"Atmos. Chem. Phys."},{"key":"D2CP01118B\/cit100\/1","doi-asserted-by":"crossref","first-page":"184","DOI":"10.1038\/nature04924","volume":"442","author":"Rohrer","year":"2006","journal-title":"Nature"},{"key":"D2CP01118B\/cit101\/1","doi-asserted-by":"crossref","first-page":"13051","DOI":"10.1021\/cr500310b","volume":"115","author":"Gligorovski","year":"2015","journal-title":"Chem. Rev."},{"key":"D2CP01118B\/cit102\/1","doi-asserted-by":"crossref","first-page":"8091","DOI":"10.1039\/C7CP00497D","volume":"19","author":"Long","year":"2017","journal-title":"Phys. Chem. Chem. Phys."}],"container-title":["Physical Chemistry Chemical Physics"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/pubs.rsc.org\/en\/content\/articlepdf\/2022\/CP\/D2CP01118B","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T03:14:33Z","timestamp":1782875673000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.rsc.org\/cp\/article\/24\/21\/13066-13073\/761003"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2022]]},"references-count":99,"journal-issue":{"issue":"21","published-print":{"date-parts":[[2022,6,1]]}},"URL":"https:\/\/doi.org\/10.1039\/d2cp01118b","relation":{},"ISSN":["1463-9076","1463-9084"],"issn-type":[{"value":"1463-9076","type":"print"},{"value":"1463-9084","type":"electronic"}],"subject":[],"published":{"date-parts":[[2022]]}}}