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Ab initio simulation of phonon spectra and lattice thermal conductivity of
monomolecular layers of transition metal dichalcogenides is performed. Size and temperature
dependence of lattice thermal conductivity are analyzed and the difference between transition
metal dichalcogenides is explained.
Keywords: dichalcogenide, phonon, thermal conductivity, transition metal, monolayer |
full paper (pdf, 1456 Kb)