Research paperComputational DFTTheoreticalElectronic and Spin-Orbit Properties of hBN Encapsulated Bilayer GrapheneKlaus Zollner, Eike Icking, Jaroslav FabianarXiv preprint·2023·10.1103/PhysRevB.108.125126·arXiv:2307.11697AbstractVan der Waals heterostructures consisting of Bernal bilayer graphene (BLG) and hexagonal boron nitride (hBN) are investigated using first-principles calculations and low-energy model Hamiltonians. The study analyzes stacking- and encapsulation-dependent orbital gaps, spin-orbit splittings, electric-field tunability, and twisted BLG/hBN structures.Read more
Bare Bernal bilayer graphene reference system used for comparison with hBN-proximitized structures.1 characterizationSimulated Supercell DftCStudied MaterialExpand
BLG on monolayer hBN with variable stacking between graphene and the substrate hBN layer.1 characterization6 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
hBN/BLG/hBN encapsulated heterostructure with variable stacking arrangements.1 characterization18 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Twisted BLG/hBN heterostructure used to analyze spatially varying local band gaps in moiré geometries.1 characterizationSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Research paperComputational DFTTheoreticalElectronic and Spin-Orbit Properties of hBN Encapsulated Bilayer GrapheneKlaus Zollner, Eike Icking, Jaroslav FabianarXiv preprint·2023·10.1103/PhysRevB.108.125126·arXiv:2307.11697AbstractVan der Waals heterostructures consisting of Bernal bilayer graphene (BLG) and hexagonal boron nitride (hBN) are investigated using first-principles calculations and low-energy model Hamiltonians. The study analyzes stacking- and encapsulation-dependent orbital gaps, spin-orbit splittings, electric-field tunability, and twisted BLG/hBN structures.Read more
Bare Bernal bilayer graphene reference system used for comparison with hBN-proximitized structures.1 characterizationSimulated Supercell DftCStudied MaterialExpand
BLG on monolayer hBN with variable stacking between graphene and the substrate hBN layer.1 characterization6 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
hBN/BLG/hBN encapsulated heterostructure with variable stacking arrangements.1 characterization18 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Twisted BLG/hBN heterostructure used to analyze spatially varying local band gaps in moiré geometries.1 characterizationSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Research paperComputational DFTTheoreticalElectronic and Spin-Orbit Properties of hBN Encapsulated Bilayer GrapheneKlaus Zollner, Eike Icking, Jaroslav FabianarXiv preprint·2023·10.1103/PhysRevB.108.125126·arXiv:2307.11697AbstractVan der Waals heterostructures consisting of Bernal bilayer graphene (BLG) and hexagonal boron nitride (hBN) are investigated using first-principles calculations and low-energy model Hamiltonians. The study analyzes stacking- and encapsulation-dependent orbital gaps, spin-orbit splittings, electric-field tunability, and twisted BLG/hBN structures.Read more
Bare Bernal bilayer graphene reference system used for comparison with hBN-proximitized structures.1 characterizationSimulated Supercell DftCStudied MaterialExpand
BLG on monolayer hBN with variable stacking between graphene and the substrate hBN layer.1 characterization6 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
hBN/BLG/hBN encapsulated heterostructure with variable stacking arrangements.1 characterization18 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Twisted BLG/hBN heterostructure used to analyze spatially varying local band gaps in moiré geometries.1 characterizationSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Research paperComputational DFTTheoreticalElectronic and Spin-Orbit Properties of hBN Encapsulated Bilayer GrapheneKlaus Zollner, Eike Icking, Jaroslav FabianarXiv preprint·2023·10.1103/PhysRevB.108.125126·arXiv:2307.11697AbstractVan der Waals heterostructures consisting of Bernal bilayer graphene (BLG) and hexagonal boron nitride (hBN) are investigated using first-principles calculations and low-energy model Hamiltonians. The study analyzes stacking- and encapsulation-dependent orbital gaps, spin-orbit splittings, electric-field tunability, and twisted BLG/hBN structures.Read more
Bare Bernal bilayer graphene reference system used for comparison with hBN-proximitized structures.1 characterizationSimulated Supercell DftCStudied MaterialExpand
BLG on monolayer hBN with variable stacking between graphene and the substrate hBN layer.1 characterization6 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
hBN/BLG/hBN encapsulated heterostructure with variable stacking arrangements.1 characterization18 propertiesSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
Twisted BLG/hBN heterostructure used to analyze spatially varying local band gaps in moiré geometries.1 characterizationSimulated Supercell DftCStudied MaterialBNStudied MaterialExpand
