Variational calculations with a hyperspherical basis on atomic helium
Autor: | Glen O. Morrell, Dwayne L. Knirk |
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Rok vydání: | 1975 |
Předmět: | |
Zdroj: | Theoretica Chimica Acta. 37:345-347 |
ISSN: | 1432-2234 0040-5744 |
DOI: | 10.1007/bf01028404 |
Popis: | We have recently formulated an expansion of the N electron wavefunction in an appropriate set of harmonics on the 3 N-dimensional hypersphere. Angular correlation appears in the usual way, while radial correlation appears as a “generalized angular” correlation. Calculations on1S helium have been performed to explore the convergence of this expansion. Energies for various angular approximations have been compared with Bunge's angular limits and show a fractional error |
Databáze: | OpenAIRE |
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