Comment on "Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be Avoided"

J Phys Chem A. 2024 Sep 12;128(36):7739-7745. doi: 10.1021/acs.jpca.4c00283. Epub 2024 Aug 27.

Authors

Montgomery Gray¹, Paige E Bowling^{1

2}, John M Herbert^{1

2}

Affiliations

¹ Department of Chemistry & Biochemistry, The Ohio State University, Columbus, Ohio 43210, United States.
² Biophysics Graduate Program, The Ohio State University, Columbus, Ohio 43210, United States.

PMID: 39190891
DOI: 10.1021/acs.jpca.4c00283

No abstract available