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The performance of the rapid estimation of basis set error and correlation energy from partial charges method on new molecules of the G3/99 test set.

Authors :
Kristyán, Sándor
Ruzsinszky, Adrienn
Csonka, Gábor I.
Source :
Theoretical Chemistry Accounts: Theory, Computation, & Modeling; Nov2001, Vol. 106 Issue 6, p404-411, 8p
Publication Year :
2001

Details

Language :
English
ISSN :
1432881X
Volume :
106
Issue :
6
Database :
Complementary Index
Journal :
Theoretical Chemistry Accounts: Theory, Computation, & Modeling
Publication Type :
Academic Journal
Accession number :
49992431
Full Text :
https://doi.org/10.1007/s002140100290