Quantum Mechanical Calculations on Light Diatomic Hydrides
Final technical rept. 12 Jun 1970-30 Sep 1972
CHICAGO UNIV IL DEPT OF CHEMISTRY
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The authors research results are presented in the form of reprints from various journals he has contributed to LiH potential curves and wavefunctions LiH properties, rotation-vibrational analysis, and transition moments Calculated states of CH Valence excited states of CH MCSCF 1. The multi-configuration self-consistent-field method Large Cl versus MCSCF Multiconfiguration self-consistent-field calculations for several states of boron Pauli approximation by many-electron atoms Steady states and quasi- energies of a quantum-mechanical system in an oscillating field Effective charge tensors of atoms in a molecule and electric dipole shielding of nuclei Induced electron current density of a molecule under a static magnetic field Self-consistent field calculations for the elastic scattering of electrons from hydrogen-like systems.
- Atomic and Molecular Physics and Spectroscopy