Sturmians and generalized sturmians in quantum theory

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Standard

Sturmians and generalized sturmians in quantum theory. / Avery, John Scales; Avery, James Emil.

Molecular electronic structures of transition metal complexes II. red. / David Michael P. Mingos; Peter Day; Jens Peder Dahl. Springer, 2012. s. 53-99 (Structure and Bonding, Bind 143).

Publikation: Bidrag til bog/antologi/rapport › Bidrag til bog/antologi › Forskning › fagfællebedømt

Harvard

Avery, JS & Avery, JE 2012, Sturmians and generalized sturmians in quantum theory. i DMP Mingos, P Day & JP Dahl (red), Molecular electronic structures of transition metal complexes II. Springer, Structure and Bonding, bind 143, s. 53-99. https://doi.org/10.1007/430_2011_53

APA

Avery, J. S., & Avery, J. E. (2012). Sturmians and generalized sturmians in quantum theory. I D. M. P. Mingos, P. Day, & J. P. Dahl (red.), Molecular electronic structures of transition metal complexes II (s. 53-99). Springer. Structure and Bonding Bind 143 https://doi.org/10.1007/430_2011_53

Vancouver

Avery JS, Avery JE. Sturmians and generalized sturmians in quantum theory. I Mingos DMP, Day P, Dahl JP, red., Molecular electronic structures of transition metal complexes II. Springer. 2012. s. 53-99. (Structure and Bonding, Bind 143). https://doi.org/10.1007/430_2011_53

Author

Avery, John Scales ; Avery, James Emil. / Sturmians and generalized sturmians in quantum theory. Molecular electronic structures of transition metal complexes II. red. / David Michael P. Mingos ; Peter Day ; Jens Peder Dahl. Springer, 2012. s. 53-99 (Structure and Bonding, Bind 143).

Bibtex

@inbook{248ac5b855574f229b0f738e43453afd,
title = "Sturmians and generalized sturmians in quantum theory",
abstract = "The theory of Sturmians and generalized Sturmians is reviewed. It is shown that when generalized Sturmians are used as basis functions, calculations on the spectra and physical properties of few-electron atoms can be performed with great ease and good accuracy. The use of many-center Coulomb Sturmians as basis functions in calculations on N-electron molecules is also discussed. Basis sets of this type are shown to have many advantages over other types of ETO{\textquoteright}s, especially the property of automatic scaling.",
keywords = "Faculty of Science, Exponential-type orbitals, Generalized Sturmians, Hyperspherical harmonics, Interelectron repulsion integrals",
author = "Avery, {John Scales} and Avery, {James Emil}",
year = "2012",
doi = "10.1007/430_2011_53",
language = "English",
isbn = "978-3-642-27377-3",
series = "Structure and Bonding",
publisher = "Springer",
pages = "53--99",
editor = "Mingos, {David Michael P.} and Peter Day and Dahl, {Jens Peder}",
booktitle = "Molecular electronic structures of transition metal complexes II",
address = "Switzerland",

}

RIS

TY - CHAP

T1 - Sturmians and generalized sturmians in quantum theory

AU - Avery, John Scales

AU - Avery, James Emil

PY - 2012

Y1 - 2012

N2 - The theory of Sturmians and generalized Sturmians is reviewed. It is shown that when generalized Sturmians are used as basis functions, calculations on the spectra and physical properties of few-electron atoms can be performed with great ease and good accuracy. The use of many-center Coulomb Sturmians as basis functions in calculations on N-electron molecules is also discussed. Basis sets of this type are shown to have many advantages over other types of ETO’s, especially the property of automatic scaling.

AB - The theory of Sturmians and generalized Sturmians is reviewed. It is shown that when generalized Sturmians are used as basis functions, calculations on the spectra and physical properties of few-electron atoms can be performed with great ease and good accuracy. The use of many-center Coulomb Sturmians as basis functions in calculations on N-electron molecules is also discussed. Basis sets of this type are shown to have many advantages over other types of ETO’s, especially the property of automatic scaling.

KW - Faculty of Science

KW - Exponential-type orbitals

KW - Generalized Sturmians

KW - Hyperspherical harmonics

KW - Interelectron repulsion integrals

U2 - 10.1007/430_2011_53

DO - 10.1007/430_2011_53

M3 - Book chapter

SN - 978-3-642-27377-3

T3 - Structure and Bonding

SP - 53

EP - 99

BT - Molecular electronic structures of transition metal complexes II

A2 - Mingos, David Michael P.

A2 - Day, Peter

A2 - Dahl, Jens Peder

PB - Springer

ER -

ID: 48839449