Fast Evaluation of Geometries and Properties of Excited Molecules in Solution: A Tamm-Dancoff Model with Application to 4-Dimethylaminobenzonitrile

This publication has 46 references indexed in Scilit:

• Analytical free energy second derivatives with respect to nuclear coordinates: Complete formulation for electrostatic continuum solvation models
  The Journal of Chemical Physics, 1999
• An efficient implementation of time-dependent density-functional theory for the calculation of excitation energies of large molecules
  The Journal of Chemical Physics, 1998
• Excited states and solvatochromic shifts within a nonequilibrium solvation approach: A new formulation of the integral equation formalism method at the self-consistent field, configuration interaction, and multiconfiguration self-consistent field level
  The Journal of Chemical Physics, 1998
• Analytical derivatives for geometry optimization in solvation continuum models. I. Theory
  The Journal of Chemical Physics, 1998
• Density Functional Study of Excited Charge Transfer State Formation in 4-(N,N-Dimethylamino)benzonitrile
  The Journal of Physical Chemistry A, 1998
• A new integral equation formalism for the polarizable continuum model: Theoretical background and applications to isotropic and anisotropic dielectrics
  The Journal of Chemical Physics, 1997
• Molecular Response Method for Solvated Molecules in Nonequilibrium Solvation
  The Journal of Physical Chemistry, 1996
• Solvent induced polarizabilities and hyperpolarizabilities of para-nitroaniline studied by reaction field linear response theory
  The Journal of Chemical Physics, 1994
• Excited-state dipole moments of dual fluorescent 4-(dialkylamino)benzonitriles: influence of alkyl chain length and effective solvent polarity
  The Journal of Physical Chemistry, 1992
• Toward a systematic molecular orbital theory for excited states
  The Journal of Physical Chemistry, 1992