Random versus Systematic Errors in Reaction Enthalpies Computed Using Semiempirical and Minimal Basis Set Methods

Bibliographic Details
Main Authors: Jimmy C. Kromann, Alexander Welford, Anders S. Christensen, Jan H. Jensen
Format: Article
Language:English
Published: American Chemical Society 2018-04-01
Series:ACS Omega
Online Access:http://dx.doi.org/10.1021/acsomega.8b00189