Erratum: Zwitterions in 3D Perovskites: Organosulfide-Halide Perovskites (Journal of the American Chemical Society (2022) 144: 49 (22403−22408) DOI: 10.1021/jacs.2c09382)

The numerical values we reported in the original publication for the orbital contributions to the valence band maximum (VBM) and conduction band minimum (CBM) states were incorrectly calculated. These errors do not affect the physical trends and interpretation we describe in the main text, and we address them with the following two corrections. Page 22404, in the paragraph that begins “We calculated...”, sentences 4 and 5: The valence-band maximum (VBM) consists of 58% (52%) S and 22% (22%) Pb, with only 19% (25%) halogen for (CYS)PbCl2 ((CYS)PbBr2). In contrast, the VBM is 33% (29%) Pb and 67% (71%) halogen in CsPbCl3 (CsPbBr3) (Figure 3C and 3D). Page 22405, the last sentence of the paragraph that began “Diffuse reflectance spectra...” on page 22404: These features are consistent with the lesser electronegativity of S compared to Cl and the smaller halide contribution (≲ 25%) in the VBM of (CYS)PbX2. We also include additional corrections to the orbital contributions reported in Table S3 of the Supporting Information (page S17).