Some corrections to GRASP92

DOI10.1016/J.CPC.2006.07.023MaRDI QIDQ709943zbMATH OpenOpenAlexFDO

Authors Yuri Ralchenko, Charlotte Froese Fischer, G. Gaigalas

Publication date 18 October 2010

Published in Computer Physics Communications (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.cpc.2006.07.023

zbMATH Keywords

correlationtransition probabilitiesatomic structurerelativistic effectsatomic energy levels\(jj\)-coupled wavefunctions\texttt{GRASP92}complex atomsE2 transitions

Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08)

Recommendations

• New version: GRASP2K relativistic atomic structure package
• The grasp2k relativistic atomic structure package
• Crystal field module for the general relativistic atomic structure package
• Relativistic radial electron density functions and natural orbitals from GRASP2018
• An atomic Dirac-Fock-Roothaan program

Cites work

• scientific article; zbMATH DE number 1043685 (Why is no real title available?)
• scientific article; zbMATH DE number 3021634 (Why is no real title available?)
• CODATA recommended values of the fundamental physical constants: 1998
• On the interaction of two electrons
• REOS99: A revised program for transition probability calculations including relativistic, correlation, and relaxation effects
• The MCHF atomic-structure package
• Über die Zuordnung von Wellenfunktionen und Eigenwerten zu den Einzelnen Elektronen Eines Atoms

Cited in

(3)

• GRASP92: a package for large-scale relativistic atomic structure calculations
• The grasp2k relativistic atomic structure package
• New version: GRASP2K relativistic atomic structure package

Describes a project that uses

Uses Software

• GRASP92

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