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Battle of the 'functionals'

Authors :
Wilson, Elizabeth K.
Source :
Chemical & Engineering News. June 30, 2008, Vol. 86 Issue 26, p34, 4 p.
Publication Year :
2008

Abstract

The shortcomings of the density functional theory (DFT) that scientists use extensively are presented. Scientists hope to overcome these problems through development of new functionals that would produce the same computational efficiency.

Details

Language :
English
ISSN :
00092347
Volume :
86
Issue :
26
Database :
Gale General OneFile
Journal :
Chemical & Engineering News
Publication Type :
Periodical
Accession number :
edsgcl.181879624