Quantum Mechanical Calculations on Light Diatomic Hydrides

Abstract

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.

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Document Details

Document Type
Technical Report
Publication Date
Jan 01, 1973
Accession Number
AD0757762

Entities

People

  • Juergen Hinze

Organizations

  • University of Chicago

Tags

Communities of Interest

  • Energy and Power Technologies

DTIC Thesaurus Topics

  • Accuracy
  • Atoms
  • Computational Science
  • Differential Equations
  • Electrons
  • Energy Levels
  • First Principles Calculations
  • Ground State
  • Magnetic Fields
  • Momentum
  • Quantum Mechanics
  • Quantum Numbers
  • Quantum Properties
  • Scattering
  • Spin-Orbit Interaction
  • Wave Equations
  • Wave Functions

Fields of Study

  • Physics

Readers

  • Quantum Chemistry
  • Quantum spin resonance or Electron Paramagnetic Resonance spectroscopy.

Technology Areas

  • Microelectronics
  • Quantum Computing
  • Quantum Science - Quantum Dots