An algorithm for the construction of fully symmetry adapted Fock matrices for molecular Hartree-Fock calculations
- P.S. Bagus
- U. Wahlgren
- 1977
- Computers and Chemistry
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188 results for P.S. Bagus
Ab initio SCF computation of force constants for CO2
- Jacob Pacansky
- Ulf Wahlgren
- et al.
- 1976
- Theoretica Chimica Acta
Hartree-Fock study of the interaction potential of He and Cl+
- K. Hermann
- P.S. Bagus
- 1976
- Chemical Physics Letters
Photoelectron peak intensities and atom/ion overlaps: An analysis of various approximations
- M. Mehta
- C.S. Fadley
- et al.
- 1976
- Chemical Physics Letters
Analysis of energy level shifts in the photoemission spectra of adsorbed molecules: CO on Ni
- P.S. Bagus
- K. Hermann
- 1976
- Solid State Communications
Ultraviolet oscillator strengths for carbon, nitrogen and oxygen ions
- J.V. Mallow
- P.S. Bagus
- 1976
- Journal of Quantitative Spectroscopy and Radiative Transfer
Effects of relativity and of the lanthanide contraction on the atoms from hafnium to bismuth
- Paul S. Bagus
- Yoon S. Lee
- et al.
- 1975
- Chemical Physics Letters
Theoretical analysis of the Auger spectra of CH4
- I.B. Ortenburger
- P.S. Bagus
- 1975
- Physical Review A
Interpretation of the photoemission spectrum of chemisorbed carbon monoxide on Ni (100)
- I.P. Batra
- P.S. Bagus
- 1975
- Solid State Communications
Ab initio Calculations for the electronic structure of carbazole and trinitrofluorenone
- I.P. Batra
- P.S. Bagus
- et al.
- 1974
- Theoretica Chimica Acta