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- W2035499364 abstract "Electron-impact ionization cross sections for diatomic molecules are calculated in a configuration-average distorted-wave method. Core bound orbitals for the molecular ion are calculated using a single-configuration self-consistent-field method based on a linear combination of Slater-type orbitals. The core bound orbitals are then transformed onto a two-dimensional $(r,ensuremath{theta})$ numerical lattice from which a Hartree potential with local exchange is constructed. The single-particle Schrodinger equation is then solved for the valence bound orbital and continuum distorted-wave orbitals with $S$-matrix boundary conditions. Total cross section results for ${mathrm{H}}_{2}$ and ${mathrm{N}}_{2}$ are compared with those from semiempirical calculations and experimental measurements." @default.
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- W2035499364 date "2007-07-19" @default.
- W2035499364 modified "2023-10-18" @default.
- W2035499364 title "Electron-impact ionization of diatomic molecules using a configuration-average distorted-wave method" @default.
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- W2035499364 doi "https://doi.org/10.1103/physreva.76.012714" @default.
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