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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 63, 1988 - Issue 4
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Original Articles

Theory of vibrational effects on properties of methane and its isotopomers

The polarizability, magnetizability, carbon-13 shielding and the one- and two-bond spin-spin coupling constants

W.T. Raynes Department of Chemistry, The University, Sheffield, S3 7HF, England
Pages 719-729 | Received 09 Oct 1987, Accepted 30 Oct 1987, Published online: 26 Oct 2007

Citations (16)

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By A. D. BUCKINGHAM and R. M. OLEGARIO. (1997) Nuclear magnetic shielding surfaces for CH3 F, CH3 Cl, and CH3 Br. Molecular Physics 92:4, pages 773-780.
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R. D. WIGGLESWORTH & W. T. RAYNES S. P. A. SAUER and J. ODDERSHEDE. (1997) The calculation and analysis of isotope effects on the nuclear spinspin coupling constants of methane at various temperatures. Molecular Physics 92:1, pages 77-88.
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W.T. Raynes, P. Lazzeretti & R. Zanasi. (1988) Vibration-rotation effects on the polarizabilities of CH4 and CD4 calculated from an ab initio polarizability surface. Molecular Physics 64:6, pages 1061-1071.
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W.T. Raynes, P.W. Fowler, P. Lazzeretti, R. Zanasi & M. Grayson. (1988) The effects of rotation and vibration on the carbon-13 shielding, magnetizabilities and geometrical parameters of some methane isotopomers. Molecular Physics 64:1, pages 143-162.
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Articles from other publishers (12)

Alexander S. Sharipov, Boris I. Loukhovitski & Ekaterina E. LoukhovitskayaAlexander S. Sharipov, Boris I. Loukhovitski & Ekaterina E. Loukhovitskaya. 2022. Influence of Internal Degrees of Freedom on Electric and Related Molecular Properties. Influence of Internal Degrees of Freedom on Electric and Related Molecular Properties 5 22 .
M. Natalia C. Zarycz, Stephan P. A. Sauer & Patricio F. Provasi. (2014) Communication: Localized molecular orbital analysis of the effect of electron correlation on the anomalous isotope effect in the NMR spin-spin coupling constant in methane. The Journal of Chemical Physics 141:15.
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Patricio F. Provasi & Stephan P. A. Sauer. (2009) Analysis of isotope effects in NMR one-bond indirect nuclear spin–spin coupling constants in terms of localized molecular orbitals. Physical Chemistry Chemical Physics 11:20, pages 3987.
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Stephan P. A. Sauer & Patricio F. Provasi. (2008) The Anomalous Deuterium Isotope Effect in the NMR Spectrum of Methane: An Analysis in Localized Molecular Orbitals. ChemPhysChem 9:9, pages 1259-1261.
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Cynthia J. Jameson. 2006. Encyclopedia of Analytical Chemistry. Encyclopedia of Analytical Chemistry.
Cynthia J. Jameson. 2007. eMagRes. eMagRes.
Angel C. de Dios & Cynthia J. Jameson. 1994. 1 69 .
Jan Geertsen, Jens Oddershede, W.T Raynes & Gustavo E Scuseria. (1991) Nuclear spin-spin coupling in the methane isotopomers. Journal of Magnetic Resonance (1969) 93:3, pages 458-471.
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David Buttar & Brian C. Webster. (1991) Vibrationally averaged β-hyperfine coupling constants for the muonium-substituted ethyl radical. J. Chem. Soc., Faraday Trans. 87:18, pages 2901-2905.
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Cynthia J. Jameson. 1991. Theoretical Models of Chemical Bonding. Theoretical Models of Chemical Bonding 457 519 .
B. Bennett & W.T. Raynes. (1989) Temperature dependent carbon-13 and proton isotope shifts of some isotopomers of methane. Spectrochimica Acta Part A: Molecular Spectroscopy 45:12, pages 1267-1271.
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B. Bennett, W.T. Raynes & C.W. Anderson. (1989) Temperature dependences of J(C,H) and J(C,D) in 13CH4 and some of its deuterated isotopomers. Spectrochimica Acta Part A: Molecular Spectroscopy 45:8, pages 821-827.
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