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Fox, Gary L., Schlegel, H. Bernhard (1990) An ab initio study of the vibrational frequencies and infrared intensities of CH2F2. The Journal of Chemical Physics, 92 (7). 4351-4356 doi:10.1063/1.457742

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Reference TypeJournal (article/letter/editorial)
TitleAn ab initio study of the vibrational frequencies and infrared intensities of CH2F2
JournalThe Journal of Chemical Physics
AuthorsFox, Gary L.Author
Schlegel, H. BernhardAuthor
Year1990 (April 1)Volume92
Issue7
PublisherAIP Publishing
DOIdoi:10.1063/1.457742Search in ResearchGate
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Mindat Ref. ID2183684Long-form Identifiermindat:1:5:2183684:8
GUID0
Full ReferenceFox, Gary L., Schlegel, H. Bernhard (1990) An ab initio study of the vibrational frequencies and infrared intensities of CH2F2. The Journal of Chemical Physics, 92 (7). 4351-4356 doi:10.1063/1.457742
Plain TextFox, Gary L., Schlegel, H. Bernhard (1990) An ab initio study of the vibrational frequencies and infrared intensities of CH2F2. The Journal of Chemical Physics, 92 (7). 4351-4356 doi:10.1063/1.457742
In(1990, April) The Journal of Chemical Physics Vol. 92 (7) AIP Publishing

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Kurnig, Ingrid J., Lischka, Hans, Karpfen, Alfred (1990) Linear versus cyclic (HCN)3: An ab initio study on structure, vibrational spectra, and infrared intensities. The Journal of Chemical Physics, 92 (4). 2469-2477 doi:10.1063/1.457990
Sosa, Carlos, Schlegel, H. Bernhard (1987) A theoretical study of the infrared vibrational intensities of CH3F. The Journal of Chemical Physics, 86 (12). 6937-6945 doi:10.1063/1.452393
Schlegel, H. Bernhard (1999) Ab initio computation of force constants. IV. The theoretical anharmonic force fields and vibrational frequencies of methylamine, methanol, and methanethiol. The Journal of Chemical Physics, 67 (9) 4181 doi:10.1063/1.435397
Schlegel, H. Bernhard (1999) Ab initio computation of force constants. V. The theoretical anharmonic force fields and vibrational frequencies of methyl fluoride and methyl chloride. The Journal of Chemical Physics, 67 (9) 4194 doi:10.1063/1.435398
Komornicki, Andrew, Jaffe, Richard L. (1979) An ab initio investigation of the structure, vibrational frequencies, and intensities of HO2 and HOCl. The Journal of Chemical Physics, 71 (5) 2150 doi:10.1063/1.438588
Ignacio, Edgar W., Schlegel, H. Bernhard (1990) Heats of formation of SiHmFn calculated by ab initio molecular orbital methods. The Journal of Chemical Physics, 92 (9). 5404-5416 doi:10.1063/1.458518
Francisco, J. S., Abersold, N. J. (1992) An ab initio study of the structure, vibrational frequencies and intensities of the chloroformyl van der Waals radical. The Journal of Chemical Physics, 96 (2). 1134-1136 doi:10.1063/1.462200
Schlegel, H. Bernhard (1982) An efficient algorithm for calculating ab initio energy gradients using s, p Cartesian Gaussians. The Journal of Chemical Physics, 77 (7) 3676-3681 doi:10.1063/1.444270
Fox, Gary L., Schlegel, H. B. (1992) An ab initio study of hydrogen atom abstractions from substituted methanes by substituted methyl radicals. The Journal of Physical Chemistry, 96 (1). 298-302 doi:10.1021/j100180a056
Manzanares I, Carlos, Walla, Dalat, Seburg, Randal, Wedlock, Michael R., Gonzalez, Carlos, Schlegel, H. Bernhard (1991) Overtone spectra of C–H bonds and vibrational ab initio study of methoxy boranes. The Journal of Chemical Physics, 95 (5). 3031-3039 doi:10.1063/1.460910
Li, Xiaosong, Millam, John M., Schlegel, H. Bernhard (2001) Glyoxal photodissociation. An ab initio direct classical trajectory study of C2H2O2→H2+2 CO. The Journal of Chemical Physics, 114 (20). 8897-8904 doi:10.1063/1.1369153
 
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