Skip to main content
U.S. Department of Energy
Office of Scientific and Technical Information

QUARTERLY PROGRESS REPORT NO. 27

Technical Report ·
OSTI ID:4336231

The average energies of confignrations of atoms and ions of Se, Ti, Fe, and Ni are calculated. Results of atomic calculations for Fe amd Ni are plotted amd tabulated, including 3d wave functions, basic wave function parameters, total atomic energy, one and two electron energies, and energy splittings. Electron population analysis and dipole moments for HF and LiH are presented. Electronic wave functions for HF molecule and electron coupled interaction between nuclear spins in the HD molecule are calculated. Results for density of states amd x-ray emission of KCl and energy bands in potassium are reported. (For preceding period see NP-6441.) (M.H.R.)

Research Organization:
Massachusetts Inst. of Tech., Cambridge. Solid-State and Molecular Theory Group
NSA Number:
NSA-12-004857
OSTI ID:
4336231
Report Number(s):
NP-6556
Country of Publication:
United States
Language:
English