Title
Relativistic correlating basis sets for 57La and 89Ac.
Abstract
Developed and reported are compact yet efficient correlating basis sets for the La-57 and Ac-89 atoms, missing in the literature. Good performance of these correlating sets is exemplified in molecular applications to diatomic oxides and fluorides. (C) 2009 Wiley Periodicals, Inc. J Comput Chem 31: 497-499, 2010
Year
DOI
Venue
2010
10.1002/jcc.21341
JOURNAL OF COMPUTATIONAL CHEMISTRY
Keywords
Field
DocType
correlating functions,lanthanum,actinium,contracted Gaussian-type functions
Diatomic molecule,Atomic physics,Computational chemistry,Chemistry,Atom,Actinium
Journal
Volume
Issue
ISSN
31
3
0192-8651
Citations 
PageRank 
References 
0
0.34
1
Authors
4
Name
Order
Citations
PageRank
Masahiro Sekiya111.98
Takeshi Noro211.64
Toshikatsu Koga332.24
Shiro L Saito400.34