Non-local pseudopotentials for electron-rare gas atom interaction
β Scribed by E. Czuchaj; J. Sienkiewicz; W. Miklaszewski
- Publisher
- Elsevier Science
- Year
- 1987
- Tongue
- English
- Weight
- 820 KB
- Volume
- 116
- Category
- Article
- ISSN
- 0301-0104
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π SIMILAR VOLUMES
A non-local core pseudopotential has been applied within a basis offloating spherical Gaussian orbitals (FSGO) to neutral and charged atoms and small molecules containing first-row cores. IIydrides with lone-pair valence orbitals were examined without variational collapse. The results for the valenc
We present a theoretical study of O(ka) and O(k 2 a 2 ) corrections to the dipole approximation in photoionization of rare gas atoms, where k is the magnitude of the photon wave vector and a is the radius of the ionized subshell. In the dipole approximation, the photoelectron angular distribution is