P. S. Bagus

Self-Consistent-Field Wave Functions for Hole States of Some Ne-Like and Ar-Like Ions

P. S. Bagus · Physical Review · 1965 · 718 citations

Correlation Energy, Engineering, Analytic Self-consistent-field +21

Interpretation of the photoemission spectrum of chemisorbed carbon monoxide on Ni (100)

I. P. Batra, P. S. Bagus · Solid State Communications · 1975 · 124 citations

Photochemistry, Atmospheric Photochemistry, Natural Sciences +6

A theoretical study of the electronic structure of ferrocene and ferricinium: Application to Mössbauer isomer shifts, ionization potentials, and conformation

P. S. Bagus, U. I. Walgren · The Journal of Chemical Physics · 1976 · 114 citations

Magnetic Properties, Engineering, Theoretical Inorganic Chemistry +19

Hartree-Fock Wavefunctions of Nominal Accuracy for He through Rb+ Calculated by the Expansion Method

P. S. Bagus, T. L. Gilbert, Clemens Roothaan · The Journal of Chemical Physics · 1972 · 104 citations

Spectral Theory, Numerical Analysis, Numerical Computation +13

Bonding and photoemission of chemisorbed molecules: Molecular orbital cluster model theory

P. S. Bagus, Klaus Hermann, Michelle C. Steel · Journal of Vacuum Science and Technology · 1981 · 98 citations

Engineering, Absorption Spectroscopy, Computational Chemistry +17