Research Article
ZnSnS3: Structure Prediction, Ferroelectricity, and Solar Cell Applications
Table 1
The predicted most stable structures of ZnSnS3 at atmospheric pressure. The space groups that describe the symmetry of the structures, the lattice constants (in Å), the angles between the lattice vectors (in degrees), and the relative energies per atom (in eV) are shown. For ease of comparison, the energy per atom of the most stable structure is set equal to zero.
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