Abstract
Bandstructure with Dirac cones gives rise to massless Dirac fermions with rich physics, and here we predict rich cone properties in M3C12S12 and M3C12O12, where M = Zn, Cd, Hg, Be, or Mg based on recently synthesized Ni3C12S12 - class 2D metal-organic frameworks (MOFs). For M3C12S12, their band structures exhibit double Dirac cones with different Fermi velocities that are n (electron) and p (hole) type, respectively, which are switchable by few-percent strain. The crossing of two cones are symmetry-protected to be non-hybridizing, leading to two independent channels at the same k-point akin to spin-channels in spintronics, rendering 'conetronics' device possible. For M3C12O12, together with conjugated metal-tricatecholate polymers M3(HHTP)2, the spin-polarized slow Dirac cone center is pinned precisely at the Fermi level, making the systems conducting in only one spin/cone channel. Quantum anomalous Hall effect can arise in MOFs with non-negligible spin-orbit coupling like Cu3C12O12. Compounds of M3C12S12 and M3C12O12 with different M, can be used to build spin/cone-selecting heterostructure devices tunable by strain or electrostatic gating, suggesting their potential applications in spintroincs/conetronics.
Original language | English (US) |
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Article number | 015015 |
Journal | 2D Materials |
Volume | 4 |
Issue number | 1 |
DOIs | |
State | Published - Mar 1 2017 |
Externally published | Yes |
All Science Journal Classification (ASJC) codes
- General Chemistry
- General Materials Science
- Condensed Matter Physics
- Mechanics of Materials
- Mechanical Engineering
Keywords
- 2D metal-organic frameworks
- Cone selecting/filtering
- Double/half Dirac cones
- First-principles calculations
- Quantum anomalous Hall effect