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Garc�a-Cruz, Isidoro, Castro, Miguel, Vivier-Bunge, Annik (2000) DFT and MP2 molecular orbital determination of OH-toluene-O2 isomeric structures in the atmospheric oxidation of toluene. Journal of Computational Chemistry, 21 (9). 716-730 doi:10.1002/(sici)1096-987x(20000715)21:9<716::aid-jcc2>3.0.co;2-h

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Reference TypeJournal (article/letter/editorial)
TitleDFT and MP2 molecular orbital determination of OH-toluene-O2 isomeric structures in the atmospheric oxidation of toluene
JournalJournal of Computational Chemistry
AuthorsGarc�a-Cruz, IsidoroAuthor
Castro, MiguelAuthor
Vivier-Bunge, AnnikAuthor
Year2000 (July 15)Volume21
Issue9
PublisherWiley
DOIdoi:10.1002/(sici)1096-987x(20000715)21:9<716::aid-jcc2>3.0.co;2-hSearch in ResearchGate
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Mindat Ref. ID3147430Long-form Identifiermindat:1:5:3147430:0
GUID0
Full ReferenceGarc�a-Cruz, Isidoro, Castro, Miguel, Vivier-Bunge, Annik (2000) DFT and MP2 molecular orbital determination of OH-toluene-O2 isomeric structures in the atmospheric oxidation of toluene. Journal of Computational Chemistry, 21 (9). 716-730 doi:10.1002/(sici)1096-987x(20000715)21:9<716::aid-jcc2>3.0.co;2-h
Plain TextGarc�a-Cruz, Isidoro, Castro, Miguel, Vivier-Bunge, Annik (2000) DFT and MP2 molecular orbital determination of OH-toluene-O2 isomeric structures in the atmospheric oxidation of toluene. Journal of Computational Chemistry, 21 (9). 716-730 doi:10.1002/(sici)1096-987x(20000715)21:93.0.co;2-h
In(2000, July) Journal of Computational Chemistry Vol. 21 (9) Wiley

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Garc�a-Cruz, Isidoro, Ruiz-Santoyo, M. E., Alvarez-Idaboy, J. Ra�l, Vivier-Bunge, Annik (1999) Ab-initio study of initial atmospheric oxidation reactions of C3 and C4 alkanes. Journal of Computational Chemistry, 20 (8). 845-856 doi:10.1002/(sici)1096-987x(199906)20:8<845::aid-jcc9>3.0.co;2-3
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Uc, Victor Hugo, García-Cruz, Isidoro, Hernández-Laguna, Alfonso, Vivier-Bunge, Annik (2000) New Channels in the Reaction Mechanism of the Atmospheric Oxidation of Toluene. The Journal of Physical Chemistry A, 104 (33). 7847-7855 doi:10.1021/jp993678d
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