Open shell cndo treatments on small and aliphatic radicals. Electronic spectra and some ground state properties

This publication has 48 references indexed in Scilit:

• Electron paramagnetic resonance of free radicals in an adamantane matrix. III. Isocyanatoalkyl and isothiocyanatoalkyl radicals
  Journal of the American Chemical Society, 1971
• Quantum Theoretical Considerations of the ortho:para Ratio for Proton Isotropic Hyperfine Coupling Constants in Benzyl Radical
  The Journal of Chemical Physics, 1971
• Conjugated radicals. VIII. A comparison of the open shell SCF results obtained by the method of Longuet-Higgins and Pople and by the method of Roothaan
  Collection of Czechoslovak Chemical Communications, 1971
• Electron resonance spectra of some radicals derived from acetylenes and nitriles
  Molecular Physics, 1971
• A theoretical analysis of the temperature dependence of the E.P.R. spectrum ofbis(trifluoromethyl) nitroxide
  Molecular Physics, 1970
• The structure and properties of CH2NO radical from molecular orbital calculations
  Journal of Molecular Structure, 1970
• A calculation on the geometry of CH+4
  Chemical Physics Letters, 1970
• Molecular Orbital Treatment of Nitric Oxide Radicals. I. Electronic Structure and Spectrum of the H2NO Radical
  Bulletin of the Chemical Society of Japan, 1969
• The vibrational fundamentals and structure of triatomic radicals formed by photolytic hydrogen-atom reactions: formyl, nitrosyl hydride and hydroperoxyl
  Spectrochimica Acta Part A: Molecular Spectroscopy, 1967
• Approximate Self-Consistent Molecular Orbital Theory. III. CNDO Results for AB2 and AB3 Systems
  The Journal of Chemical Physics, 1966