Electronic Resource
New York, NY
:
Wiley-Blackwell
International Journal of Quantum Chemistry
12 (1977), S. 545-547
ISSN:
0020-7608
Keywords:
Computational Chemistry and Molecular Modeling
;
Atomic, Molecular and Optical Physics
Source:
Wiley InterScience Backfile Collection 1832-2000
Topics:
Chemistry and Pharmacology
Notes:
The two-parameter function, ϕ = (C1 + C2rn-1) exp (-ζr), (n = 2-5), has been used as a basis function to determine the independent particle model energy of two-electron atomic systems in their ground state. The best energy is found for n = 3 (He - B3+) and for n = 4 (H-). Our energy values are significantly close to Hartree-Fock results.
Additional Material:
1 Tab.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1002/qua.560120312
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