Barrier to internal rotation of dimethyl ether: ab initio SCF study including structure relaxation and comparison to experimental results

This publication has 20 references indexed in Scilit:

• Analysis of torsional spectra of molecules with two internal C3v rotors. II. Far infrared and low frequency Raman spectra of dimethylether isotopes
  The Journal of Chemical Physics, 1977
• Analysis of torsional splittings in the microwave spectra of dimethylether, CH3OCH3 and its isotopes, CD3OCH3 and CD3OCD3
  Journal of Molecular Spectroscopy, 1976
• Molecular orbital theory of the electronic structure of organic compounds. XXI. Rotational potentials for germinal methyl groups
  Journal of the American Chemical Society, 1974
• Ein Beitrag zur Analyse der Torsionsfeinstruktur Rotationsspektren von Molekiilen mit zwei Methylgruppen / A Contribution to the Analysis of Rotational Spectra of Two-Top Molecules
  Zeitschrift für Naturforschung A, 1973
• Zur Analyse der Rotationsspektren in torsionsangeregten Zuständen von Molekülen mit zwei Methylgruppen/A Contribution to the Analysis of Rotational Spectra in Torsional Excited States of Molecules with two Methyl Tops
  Zeitschrift für Naturforschung A, 1973
• Self-Consistent Molecular Orbital Methods. XIII. An Extended Gaussian-Type Basis for Boron
  The Journal of Chemical Physics, 1972
• Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules
  The Journal of Chemical Physics, 1971
• Notizen: Bestimmung höherer Potentialkoeffizienten des Hinderungspotentials von Molekülen mit zwei Methylgruppen
  Zeitschrift für Naturforschung A, 1968
• Gaussian Lobe Function Expansions of Hartree—Fock Solutions for the First-Row Atoms and Ethylene
  The Journal of Chemical Physics, 1966
• Gaussian Expansion of Hydrogen-Atom Wavefunctions
  The Journal of Chemical Physics, 1963