526 citations
- Chinese Academy of SciencesCN36 papers
- Aalto UniversityFI34 papers
- Institute of Theoretical PhysicsCN23 papers
- Institute of High Energy PhysicsCN17 papers
- Loughborough UniversityGB17 papers
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Showing 2021 · cond-mat.mtrl-sciShow all
3 papers · 2 filters
cond-mat.mtrl-sci2021★ 18 cited
Heat transport across graphene/hexagonal-BN tilted grain boundaries from phase-field crystal model and molecular dynamics simulations
Haikuan Dong, Petri Hirvonen, Zheyong Fan +3
We study the interfacial thermal conductance of grain boundaries (GBs) between monolayer graphene and hexagonal boron nitride (h-BN) sheets using a combined atomistic approach. Fir…
cond-mat.mtrl-sci2021★ 6 cited
Quantum spin Hall effect in two-dimensional transition-metal chalcogenides
Xing Wang, Wenhui Wan, Yanfeng Ge +2
Based on first-principles calculations, we have found a family of 2D transition-metal (TM) chalcogenides MX5 (M = Zr, Hf and X = S, Se and Te) can host quantum spin Hall (QSH) effe…
cond-mat.mtrl-sci2021★ 95 cited
Spectral Decomposition of Thermal Conductivity: Comparing Velocity Decomposition Methods in Homogeneous Molecular Dynamics Simulations
Alexander J. Gabourie, Zheyong Fan, Tapio Ala-Nissila +1
The design of new applications, especially those based on heterogeneous integration, must rely on detailed knowledge of material properties, such as thermal conductivity (TC). To t…