Computational Chemistry Comparison and Benchmark Database
This note covers the following topics:
Experimental data, Calculated data, Data comparisons, Cost comparisons, Input
and output files, Geometries, Vibrations, Reaction data, Entropy data,
Bibliographic data, Ion data, Bad calculations, Index of properties and H-bond
dimers.
Author(s): U.S. Secretary of Commerce on
behalf of the United States of America
NA Pages