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All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on Ca3BiSb by Materials Project

Ca3BiSb is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one antimony molecule and one Ca3Bi framework. In the Ca3Bi framework, Ca is bonded in a linear geometry to two equivalent Bi atoms. Both Ca–Bi bond lengths are 2.93 Å. Bi is bonded to six equivalent Ca atoms to form corner-sharing BiCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ca3BiSb by Materials Project

Ca3SbBi is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one bismuth molecule and one Ca3Sb framework. In the Ca3Sb framework, Ca is bonded in a linear geometry to two equivalent Sb atoms. Both Ca–Sb bond lengths are 2.90 Å. Sb is bonded to six equivalent Ca atoms to form corner-sharing SbCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗