Fig. 1: Evolution of band structures due to different compressive strains. | npj Computational Materials

Fig. 1: Evolution of band structures due to different compressive strains.

From: Simultaneous enhancement in electrical conductivity and Seebeck coefficient by single- to double-valley transition in a Dirac-like band

Fig. 1

The left plots show the ab initio electron band structures of GeTe (red), SnTe (blue), and PbTe (green). The solid and dashed lines represent the crystal with and without a 3% compressive strain, respectively. The right plot schematically illustrates the transition of the band structure of SnTe after compression. The bottoms of the two new-formed conduction valleys in SnTe are denoted as Q (located at 0.4831b1 + 0.5169b2 + 0.5000b3 in the direction from the L to W point) and Λ (located at 0.4575b1 + 0.4575b2 + 0.4575b3 in the direction from the L to Г point), where b is the reciprocal lattice vector.

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