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Force fields for nitriles

dc.contributor.authorYamadera, Reizoen_US
dc.contributor.authorKrimm, Samuelen_US
dc.date.accessioned2006-04-17T15:25:28Z
dc.date.available2006-04-17T15:25:28Z
dc.date.issued1968-11en_US
dc.identifier.citationYamadera, Reizo, Krimm, S. (1968/11)."Force fields for nitriles." Spectrochimica Acta Part A: Molecular Spectroscopy 24(11): 1677-1686. <http://hdl.handle.net/2027.42/33089>en_US
dc.identifier.urihttp://www.sciencedirect.com/science/article/B6THM-44D5J2R-FB/2/9ba8fc35ebf20134abb20c1ec0ba8d9fen_US
dc.identifier.urihttps://hdl.handle.net/2027.42/33089
dc.description.abstractA valence force field for nitriles based on the force field obtained for hydrocarbons is found to give very good agreement with the observed bands for several mono- and di-nitrile molecules. The average deviation between observed and calculated frequencies for the 238 assigned frequencies is 0.98[deg]. This is a significant improvement over the results obtained previously with a Urey--Bradley force field.en_US
dc.format.extent713841 bytes
dc.format.extent3118 bytes
dc.format.mimetypeapplication/pdf
dc.format.mimetypetext/plain
dc.language.isoen_US
dc.publisherElsevieren_US
dc.titleForce fields for nitrilesen_US
dc.typeArticleen_US
dc.rights.robotsIndexNoFollowen_US
dc.subject.hlbsecondlevelMaterials Science and Engineeringen_US
dc.subject.hlbsecondlevelChemistryen_US
dc.subject.hlbsecondlevelChemical Engineeringen_US
dc.subject.hlbsecondlevelBiological Chemistryen_US
dc.subject.hlbtoplevelEngineeringen_US
dc.subject.hlbtoplevelScienceen_US
dc.subject.hlbtoplevelHealth Sciencesen_US
dc.description.peerreviewedPeer Revieweden_US
dc.contributor.affiliationumHarrison M. Randall Laboratory of Physics, The University of Michigan Ann Arbor, Michigan U.S.A.en_US
dc.contributor.affiliationumHarrison M. Randall Laboratory of Physics, The University of Michigan Ann Arbor, Michigan U.S.A.en_US
dc.description.bitstreamurlhttp://deepblue.lib.umich.edu/bitstream/2027.42/33089/1/0000475.pdfen_US
dc.identifier.doihttp://dx.doi.org/10.1016/0584-8539(68)80222-3en_US
dc.identifier.sourceSpectrochimica Acta Part A: Molecular Spectroscopyen_US
dc.owningcollnameInterdisciplinary and Peer-Reviewed


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