{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,20]],"date-time":"2026-10-20T03:33:29Z","timestamp":1792467209165,"version":"4.5.0"},"reference-count":53,"publisher":"American Chemical Society (ACS)","issue":"16","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Environ. Sci. Technol."],"published-print":{"date-parts":[[2009,8,15]]},"DOI":"10.1021\/es900956c","type":"journal-article","created":{"date-parts":[[2009,7,17]],"date-time":"2009-07-17T07:44:52Z","timestamp":1247816692000},"page":"6220-6227","source":"Crossref","is-referenced-by-count":262,"title":["Development of a Group Contribution Method To Predict Aqueous Phase Hydroxyl Radical (HO\u2022) Reaction Rate Constants"],"prefix":"10.1021","volume":"43","author":[{"given":"Daisuke","family":"Minakata","sequence":"first","affiliation":[{"name":"School of Civil and Environmental Engineering, Georgia Institute of Technology, 800 West Peachtree Street, Suite 400 F\u2212H, Atlanta, Georgia 30332, Faculty of Engineering, University of Georgia, Athens, Georgia 30602, and Department of Civil, Environmental and Sustainable Engineering, Arizona State University, P.O. Box 5306, Tempe, Arizona 85287"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Ke","family":"Li","sequence":"additional","affiliation":[{"name":"School of Civil and Environmental Engineering, Georgia Institute of Technology, 800 West Peachtree Street, Suite 400 F\u2212H, Atlanta, Georgia 30332, Faculty of Engineering, University of Georgia, Athens, Georgia 30602, and Department of Civil, Environmental and Sustainable Engineering, Arizona State University, P.O. Box 5306, Tempe, Arizona 85287"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Paul","family":"Westerhoff","sequence":"additional","affiliation":[{"name":"School of Civil and Environmental Engineering, Georgia Institute of Technology, 800 West Peachtree Street, Suite 400 F\u2212H, Atlanta, Georgia 30332, Faculty of Engineering, University of Georgia, Athens, Georgia 30602, and Department of Civil, Environmental and Sustainable Engineering, Arizona State University, P.O. Box 5306, Tempe, Arizona 85287"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"John","family":"Crittenden","sequence":"additional","affiliation":[{"name":"School of Civil and Environmental Engineering, Georgia Institute of Technology, 800 West Peachtree Street, Suite 400 F\u2212H, Atlanta, Georgia 30332, Faculty of Engineering, University of Georgia, Athens, Georgia 30602, and Department of Civil, Environmental and Sustainable Engineering, Arizona State University, P.O. Box 5306, Tempe, Arizona 85287"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2009,7,17]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"crossref","first-page":"6649","DOI":"10.1021\/es0484799","volume":"39","author":"Westerhoff P.","year":"2005","journal-title":"Environ. Sci. Technol."},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"1016","DOI":"10.1021\/es025896h","volume":"37","author":"Huber M. M.","year":"2003","journal-title":"Environ. Sci. Technol."},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"5476","DOI":"10.1021\/es035413p","volume":"38","author":"Rosenfeldt E. J.","year":"2004","journal-title":"Environ. Sci. Technol."},{"key":"ref4\/cit4","unstructured":"CAS (Chemical Abstract Service), division of the American Chemical Society.http:\/\/www.cas.org\/expertise\/cascontent\/index.html(accessed June 12, 2009)."},{"issue":"20","key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"5045","DOI":"10.1016\/j.watres.2008.09.017","volume":"42","author":"Li K.","year":"2008","journal-title":"Water Res."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"1696","DOI":"10.1021\/es0607638","volume":"41","author":"Li K.","year":"2007","journal-title":"Environ. Sci. Technol."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"2382","DOI":"10.1021\/es950866i","volume":"30","author":"Stefan M. I.","year":"1996","journal-title":"Environ. Sci. Technol."},{"issue":"10","key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"2315","DOI":"10.1016\/S0043-1354(98)00448-5","volume":"33","author":"Crittenden J. C.","year":"1999","journal-title":"Water Res."},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"2831","DOI":"10.1021\/es802039y","volume":"43","author":"Li K.","year":"2009","journal-title":"Environ. Sci. Technol."},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"69","DOI":"10.1021\/cr00071a004","volume":"86","author":"Atkinson R.","year":"1986","journal-title":"Chem. Rev."},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"799","DOI":"10.1002\/kin.550190903","volume":"19","author":"Atkinson R.","year":"1987","journal-title":"Int. J. Chem. Kinet."},{"issue":"14","key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"1685","DOI":"10.1016\/1352-2310(95)00069-B","volume":"29","author":"Kwok E. S. C.","year":"1995","journal-title":"Atmos. Environ."},{"key":"ref13\/cit13","doi-asserted-by":"crossref","first-page":"651","DOI":"10.1002\/kin.550130706","volume":"13","author":"Heicklen J.","year":"1981","journal-title":"Int. J. Chem. Kinet."},{"issue":"4","key":"ref14\/cit14","doi-asserted-by":"crossref","first-page":"717","DOI":"10.1016\/0045-6535(95)00352-5","volume":"32","author":"Klamt A.","year":"1996","journal-title":"Chemosphere."},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"11391","DOI":"10.1021\/jp8052218","volume":"112","author":"B\u00f6hnhardt A.","year":"2008","journal-title":"J. Phys. Chem. A"},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"1339","DOI":"10.1002\/kin.550141206","volume":"14","author":"Cohen N.","year":"1982","journal-title":"Int. J. Chem. Kinet."},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"1064","DOI":"10.1021\/ci990042a","volume":"39","author":"Bakken G.","year":"1999","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ref18\/cit18","volume-title":"AOPWIN","year":"2000","edition":"1"},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"289","DOI":"10.1016\/0047-2670(81)80051-2","volume":"16","author":"Schuchmann H.-P.","year":"1981","journal-title":"J. Photochem."},{"key":"ref20\/cit20","volume-title":"Continuum Solvation Models in Chemical Physics","author":"Persico M.","year":"2007"},{"key":"ref21\/cit21","unstructured":"Cramer, C. J.Essential of Computational Chemistry,2nded.John Wiley & Sons. Ltd.:Chichester, U.K., 2004; Chapter11."},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"7667","DOI":"10.1016\/j.atmosenv.2005.03.019","volume":"39","author":"Monod A.","year":"2005","journal-title":"Atmos. Environ."},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"4691","DOI":"10.1021\/cr020658q","volume":"103","author":"Herrmann H.","year":"2003","journal-title":"Chem. Rev."},{"key":"ref24\/cit24","doi-asserted-by":"crossref","first-page":"269","DOI":"10.1016\/S1352-2310(02)00777-X","volume":"37","author":"Dutot A.-L.","year":"2003","journal-title":"Atmos. Environ."},{"key":"ref25\/cit25","volume-title":"Thermochemical Kinetics","author":"Benson S. W.","year":"1976","edition":"2"},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"171","DOI":"10.1021\/j100285a037","volume":"91","author":"Cohen N.","year":"1987","journal-title":"J. Phys. Chem."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"397","DOI":"10.1002\/kin.550230506","volume":"23","author":"Cohen N.","year":"1991","journal-title":"Int. J. Chem. Kinet"},{"key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"6812","DOI":"10.1021\/ja00438a006","volume":"98","author":"Singleton D. L.","year":"1976","journal-title":"J. Am. Chem. Soc."},{"issue":"7","key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"3009","DOI":"10.1063\/1.1768933","volume":"121","author":"Davey J. B.","year":"2004","journal-title":"J. Chem. Phys."},{"issue":"5","key":"ref30\/cit30","first-page":"673","volume":"37","author":"Getoff N.","year":"1991","journal-title":"Radiat. Phys. Chem."},{"key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"264","DOI":"10.1039\/b008434o","author":"Mvula E.","year":"2001","journal-title":"J. Chem. Soc., Perkin Trans. 2"},{"issue":"10","key":"ref32\/cit32","doi-asserted-by":"crossref","first-page":"3495","DOI":"10.1021\/ja00530a031","volume":"102","author":"Raghavan N. V.","year":"1980","journal-title":"J. Am. Chem. Soc."},{"key":"ref33\/cit33","doi-asserted-by":"crossref","first-page":"1097","DOI":"10.1039\/P29960001097","author":"Merga G.","year":"1996","journal-title":"J. Chem. Soc., Perkin Trans. 2"},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"1287","DOI":"10.1021\/jp808057c","volume":"113","author":"Razavi B.","year":"2009","journal-title":"J. Phys. Chem. A."},{"key":"ref35\/cit35","first-page":"141","volume-title":"S-Centered Radicals, The Chemistry of Free Radicals","author":"Asmus K.-D.","year":"1999"},{"key":"ref36\/cit36","volume-title":"Genetic Algorithms in Search, Optimization, and Machine Learning","author":"Goldberg D. E.","year":"1989"},{"key":"ref37\/cit37","volume-title":"A User\u2019s Guide to PIKAIA 1.0","author":"Charbonneau P.","year":"1995"},{"issue":"2","key":"ref38\/cit38","doi-asserted-by":"crossref","first-page":"513","DOI":"10.1063\/1.555805","volume":"17","author":"Buxton V. B.","year":"1988","journal-title":"J. Phys. Chem. Ref. Data."},{"key":"ref39\/cit39","unstructured":"The Radiation Chemistry Data Center (RCDC), Notre Dame Radiation Laboratory, University of Notre Dame.http:\/\/www.rad.nd.edu\/rcdc\/index.html(accessed June 12, 2009)."},{"key":"ref40\/cit40","volume-title":"Science Advisory Board Review of the Estimation Programs Interface (EPI) Suite","year":"2007"},{"key":"ref41\/cit41","first-page":"69","volume":"33","author":"Elliot A. J.","year":"1989","journal-title":"Radiat. Phys. Chem."},{"issue":"10","key":"ref42\/cit42","doi-asserted-by":"crossref","first-page":"1218","DOI":"10.1021\/j100629a007","volume":"77","author":"Asmus K.-D.","year":"1973","journal-title":"J. Phy. Chem."},{"issue":"6","key":"ref43\/cit43","doi-asserted-by":"crossref","first-page":"749","DOI":"10.1021\/j100676a004","volume":"75","author":"Getoff N.","year":"1971","journal-title":"J. Phys. Chem."},{"key":"ref44\/cit44","doi-asserted-by":"crossref","DOI":"10.1201\/9781420039863","volume-title":"Handbook of Bond Dissociation Energies in Organic Compounds","author":"Luo Y.-R.","year":"2002"},{"key":"ref45\/cit45","volume-title":"Molecular Descriptors in QSAR\/QSPR","author":"Karelson M.","year":"2000"},{"key":"ref46\/cit46","doi-asserted-by":"crossref","first-page":"6031","DOI":"10.1021\/jp058041a","volume":"109","author":"Greenwald E. E.","year":"2005","journal-title":"J. Phy. Chem. A."},{"key":"ref47\/cit47","doi-asserted-by":"crossref","first-page":"3715","DOI":"10.1021\/ja993693w","volume":"122","author":"Alvarez-Idaboy J. R.","year":"2000","journal-title":"J. Am. Chem. Soc."},{"key":"ref48\/cit48","doi-asserted-by":"crossref","first-page":"1618","DOI":"10.1021\/jp066973o","volume":"111","author":"Peeters J.","year":"2007","journal-title":"J. Phy. Chem. A."},{"issue":"11","key":"ref49\/cit49","doi-asserted-by":"crossref","first-page":"1631","DOI":"10.1039\/FT9959101631","volume":"91","author":"Ashton L.","year":"1995","journal-title":"J. Chem. Soc., Faraday. Trans."},{"issue":"6","key":"ref50\/cit50","doi-asserted-by":"crossref","first-page":"825","DOI":"10.1016\/0969-806X(93)90028-S","volume":"41","author":"Solar S.","year":"1993","journal-title":"Radiat. Phys. Chem."},{"key":"ref51\/cit51","doi-asserted-by":"crossref","first-page":"4732","DOI":"10.1021\/jp056017r","volume":"110","author":"Mezyk S. P.","year":"2006","journal-title":"J. Phy. Chem. A."},{"key":"ref52\/cit52","doi-asserted-by":"crossref","first-page":"3161","DOI":"10.1021\/es0347742","volume":"38","author":"Mezyk S. P.","year":"2004","journal-title":"Environ. Sci. Technol."},{"issue":"13","key":"ref53\/cit53","doi-asserted-by":"crossref","first-page":"3898","DOI":"10.1021\/ja00716a011","volume":"92","author":"Hayon E.","year":"1970","journal-title":"J. Am. Chem. Soc."}],"container-title":["Environmental Science & Technology"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/es900956c","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,5]],"date-time":"2023-04-05T10:10:39Z","timestamp":1680689439000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/es900956c"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2009,7,17]]},"references-count":53,"journal-issue":{"issue":"16","published-print":{"date-parts":[[2009,8,15]]}},"alternative-id":["10.1021\/es900956c"],"URL":"https:\/\/doi.org\/10.1021\/es900956c","relation":{},"ISSN":["0013-936X","1520-5851"],"issn-type":[{"value":"0013-936X","type":"print"},{"value":"1520-5851","type":"electronic"}],"subject":[],"published":{"date-parts":[[2009,7,17]]}}}