Higher order anharmonicity and polymorphism in the lattice thermal conductivity of transition metal dichalcogenides

Marta Loletti, Qi Ren, Zhuyao Chang +6

We present a comprehensive {\it ab initio} study of the effect of higher-order anharmonicity and polymorphism on the lattice thermal conductivity, $\mathbf{\kappa }$, of single-layer transi…