Tailoring graphene magnetism by zigzag triangular holes: A first-principles thermodynamics study
We discuss the thermodynamic stability and magnetic property of zigzag triangular holes (ZTHs) in graphene based on the results of first-principles density functional theory calculations. We find that ZTHs with hydrogen-passivated edges in mixed sp2/sp3 configurations (z211) could be readily availab...
| Main Authors: | , , , , |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
AIP Publishing LLC
2016-03-01
|
| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/1.4945400 |