February 22, 2024
Journal Article

Erratum Breaking covalent bonds in the context of the many-body expansion (MBE). I. The purported “first row anomaly” in XHn (X = C, Si, Ge, Sn; n = 1–4) [J. Chem. Phys. 156, 244303 (2022)]

Abstract

We have noted typographical errors in TABLE V of J. Chem. Phys. 156, 244303 (2022). Specifically, the values of the angles f??? for the XH2 species in both the (3 B1) and (1A1) states were incorrectly reported as half of the correct values. The values of the same angles for the XH3 and XH4 species were reported correctly

Published: February 22, 2024

Citation

Tzeli D., and S.S. Xantheas. 2024. Erratum Breaking covalent bonds in the context of the many-body expansion (MBE). I. The purported “first row anomaly” in XHn (X = C, Si, Ge, Sn; n = 1–4) [J. Chem. Phys. 156, 244303 (2022)]. Journal of Chemical Physics 160, no. 5:Art. No. 059901. PNNL-SA-194888. doi:10.1063/5.0196893

Research topics

Computational Chemistry