Rototranslational and Virial Sum Rules for Geometrical Derivatives of Second-Order Properties and Nuclear Electric Hypershieldings

This publication has 33 references indexed in Scilit:

• Theoretical study of infrared spectra perturbed by uniform electric fields: A b i n i t i o calculations on H2O, NH3, H2CO, and C2H4
  The Journal of Chemical Physics, 1991
• Electric field induced change of adsorbate vibrational line strength
  The Journal of Chemical Physics, 1991
• Calculation of the vibrational frequency and line strength versus applied field of carbon monoxide
  Chemical Physics, 1991
• Influence of an external uniform electric field on harmonic vibrational frequencies. Analytic energy second derivatives for closed-shell restricted Hartree–Fock wave functions with an applied uniform electric field
  The Journal of Chemical Physics, 1989
• Electric fields acting as catalysts in chemical reactions. An ab initio study of the walden inversion reaction
  Chemical Physics Letters, 1988
• An ab initio study of the electric field influence on the electron distribution of HCN, CH3CN, CH2CHCN, and CH2C(CN)2
  Chemical Physics Letters, 1988
• Effect of an electric field on a methane molecule. I. Infrared analysis of methane (CH4–CD4) adsorbed in NaA zeolite in the temperature range 150–20 K
  The Journal of Chemical Physics, 1985
• Effect of an electric field on a methane molecule. II. Calculation of the degeneracy splitting of the ν3 band. Expression of the second derivatives of the CH4 dipole moment and evaluation of the second derivative of the C–H bond polarizability
  The Journal of Chemical Physics, 1985
• The effect of an external electric field on the vibrational frequency of CO
  Chemical Physics Letters, 1985
• Electric‐Field‐Induced Spectral Shifts of the OH Vibrational Absorption Line in Alcohols
  The Journal of Chemical Physics, 1967