First principles computation of new topological b2x2zn (x = ir, rh, co) compounds

HIGHLIGHTS

• who: Jack Howard et al. from the Department of Physics, Seton Hall University, South Orange, NJ, USA have published the research work: First Principles Computation of New Topological B2X2Zn (X = Ir, Rh, Co) Compounds, in the Journal: J 2023, 6, 152-163. of /2023/
• what: The authors investigate the compound for topological crystalline insulating behavior by conducting surface state calculation and by investigating gapping behavior by increasing lattice parameters. The authors report calculated electronic band structures of B2 X2 Zn after completing the full volume optimization process by allowing the rearrangement of atomic positions and . . .
  

   

  

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