Correlated description of multiple bonds using localized active orbitals

This publication has 14 references indexed in Scilit:

• Ab initio determination of an extended Heisenberg Hamiltonian in CuO 2 layers
  Zeitschrift für Physik B Condensed Matter, 2001
• Proposal of an extendedt−JHamiltonian for high-Tccuprates fromab initiocalculations on embedded clusters
  Physical Review B, 2001
• The effect of dynamical correlation on the valence wavefunction of molecules: Dressed complete active space self-consistent field calculations
  Chemical Physics, 1990
• Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions
  Theoretical Chemistry Accounts, 1990
• The effect of electronic correlation on molecular wavefunctions
  Chemical Physics, 1986
• Single excitations on multideterminantal CI wavefunctions: A treatment of the left—right correlation in multiple metal—metal bonds. Theory
  Chemical Physics Letters, 1985
• The valence bond description of conjugated molecules i.SCFlevel
  International Journal of Quantum Chemistry, 1985
• Valence-bond description of conjugated molecules. 3. The through-resonance concept in para-substituted nitrobenzenes
  Journal of the American Chemical Society, 1984
• Octachlorodimolybdate(II) ion. Species with a quadruple metal-metal bond
  Inorganic Chemistry, 1969
• Antiferromagnetic Superexchange Effect
  Physical Review B, 1960