Correction to Structural Tolerance Factor Approach to Defect-Resistant I 2 -II-IV-X 4 Semiconductor Design

In our original manuscript, the energy band structure of Ag2PbSiS4 in the Ama2 structure, shown in Figure 11d and calculated at the level of the hybrid density functional HSE06, was mistakenly calculated without including the effects of spin- orbit coupling (SOC). The corresponding computed energy gap (Table 4) and optical properties (Figure 12) for this compound also did not include SOC. For all other compounds for which computational results are provided, SOC was included correctly. (Figure Presented).

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Author Volker Blum Thomas Lord Department of Mechanical Engineering and Materia ...

Author David Mitzi Thomas Lord Department of Mechanical Engineering and Materia ...