Accurate computations of bound state properties in three- and four-electron atomic systems in the basis of multi-dimensional gaussoids

DOI10.1007/S10910-016-0671-2MaRDI QIDQ511887zbMATH OpenOpenAlexFDO

Authors Alexei M. Frolov, David M. Wardlaw

Publication date 22 February 2017

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://arxiv.org/abs/1604.06355

zbMATH Keywords

bound statesberyllium isotopeslithium ion

Mathematics Subject Classification ID

Molecular physics (81V55) Quantum state spaces, operational and probabilistic concepts (81P16)

Abstract: Results of accurate computations of bound states in three- and four-electron atomic systems are discussed. Bound state properties of the four-electron lithium ion Li${}^{-}$ in its ground $2^{2}S-$state are determined from the results of accurate, variational computations. We also consider a closely related problem of accurate numerical evaluation of the half-life of the beryllium-7 isotope. This problem is of paramount importance for modern radiochemistry.

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(8)

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• The \(HD\) and \(H\bar D\) methods for accelerating the convergence of three-center nuclear attraction and four-center two-electron Coulomb integrals over \(B\) functions and their convergence properties
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