Asymptotic estimates of expectation values for atom
β Scribed by Dmitrieva, I. K. ;Plindov, G. I.
- Publisher
- Springer
- Year
- 1982
- Tongue
- English
- Weight
- 296 KB
- Volume
- 305
- Category
- Article
- ISSN
- 1434-601X
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π SIMILAR VOLUMES
Estimators of the extreme-value index are based on a set of upper order statistics. When the number of upper-order statistics used in the estimation of the extreme-value index is small, the variance of the estimator will be large. On the other hand, the use of a large number of upper statistics will
The MOEXVA program implements the recent formulation for the evaluation of momentum expectation values of diatomic molecules Β’J\_.M. Garcia de la Vega et al., J. Math. Chem. 21 (1993) 211 ), adapting this formulation to the general problem of polyatomic molecules. The program uses as input the molec
## Abstract A generalization of a method to calculate lower bounds to expectation values of nonβnegative observables is presented. We consider bounds to three electronic expectation values γ__r__^2^γ, γ__r__γ, and γ__r__^β1^γ in the helium atom as an example. For both γ__r__^2^γ and γ__r__γ, we are
## Abstract The HartreeβFock and first natural spin determinants were compared as reference determinants for calculating various oneβelectron properties such as Ο(0), γΒ½βγ, γ__r__^β2^γ,β¦, γ__r__^3^γ, and __r__^β1^~12~γ. Calculations were made on various small atoms and their positive and negative i