Concepedia

Distinct anharmonic characteristics of phonon-driven lattice thermal conductivity and thermal expansion in bulk MoSe<sub>2</sub> and WSe<sub>2</sub>

Mayanak K. Gupta, S. Kumar, R. Mittal, S. K. Mishra, S. Rols, Olivier Delaire, Arumugum Thamizhavel, P. U. Sastry, S. L. Chaplot

Journal of Materials Chemistry A · 2023 · 39 citations · 67 references

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Abstract

Machine-learning molecular dynamics simulations pave the way to completely treat the anharmonicity of phonons. Low-energy anharmonic modes in transition-metal dichalcogenides drive the thermal and transport properties.

References

67

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