An Examination of Intrinsic Errors in Electronic Structure Methods Using the Environmental Molecular Sciences Laboratory Computational Results Database and the Gaussian-2 Set

January 1, 1998

Journal Article

An Examination of Intrinsic Errors in Electronic Structure Methods Using the Environmental Molecular Sciences Laboratory Computational Results Database and the Gaussian-2 Set

Abstract

Revised: January 23, 2019 | Published: January 1, 1998

Citation

Feller D.F., and K.A. Peterson. 1998. An Examination of Intrinsic Errors in Electronic Structure Methods Using the Environmental Molecular Sciences Laboratory Computational Results Database and the Gaussian-2 Set. Journal of Chemical Physics 108, no. 1:154-176. PNNL-SA-29230. doi:10.1063/1.475370