2024
- Vacancies Tailoring Lattice Anharmonicity of Zintl-Type Thermoelectrics , Nat. Commun., 1 (2024) 15.
- Amorphous-Like Ultralow Thermal Transport in Crystalline Argyrodite $\mathrm{Cu}_7\mathrm{PS}_6$ , Adv. Sci., 16 (2024) 11.
2023
- Phonon Transport in Freestanding $\mathrm{SrTiO}_{3}$ down to the Monolayer Limit , Phys. Rev. B, 11 (2023) 108.
2022
- Role of Alloying in the Phonon and Thermal Transport of SnS-SnSe Across the Phase Transition , Mater. Today Phys., (2022) 28.
- Temperature- and Pressure-Dependent Phonon Transport Properties of $\mathrm{SnS}$ Across Phase Transition from Machine-Learning Interatomic Potential , Int. J. Heat Mass Transf., (2022) 192.
2021
- Soft-Mode Dynamics in the Ferroelectric Phase Transition of $\mathrm{GeTe}$ , Npj Comput. Mater., 1 (2021) 7.
- Anharmonic Lattice Dynamics of $\mathrm{SnS}$ Across Phase Transition: A Study Using High-Dimensional Neural Network Potential , Appl. Phys. Lett., 6 (2021) 119.
2020
- Dynamic Disorder Phonon Scattering Mediated by Cu Atomic Hopping and Diffusion in $\mathrm{Cu}_3\mathrm{SbSe}_3$ , Npj Comput. Mater., 1 (2020) 6.
- Highly Selective Phonon Diffusive Scattering in Superionic Layered $\mathrm{AgCrSe}_2$ , Npj Comput. Mater., 1 (2020) 6.
2018
- Giant Phonon Tuning Effect via Pressure-Manipulated Polar Rotation in Perovskite $\mathrm{MAPbI}_{3}$ , J. Phys. Chem. Lett., 11 (2018) 9.
- A Density Functional Theory Parameterised Neural Network Model of Zirconia , Mol. Simul., 8 (2018) 44.
- Anharmonic Lattice Dynamics of $\mathrm{BCC}$ Sodium Under High Pressures , Phys. Chem. Chem. Phys., 21 (2018) 20.
- Orbital Alignment for High Performance Thermoelectric $\mathrm{YbCd}_2\mathrm{Sb}_2$ Alloys , Chem. Mater., 15 (2018) 30.
- $\mathrm{MnTe}_2$ as a Novel Promising Thermoelectric Material , J. Materiomics, 3 (2018) 4.
2017
- Single Parabolic Band Transport in P-Type $\mathrm{EuZn}_2\mathrm{Sb}_2$ Thermoelectrics , J. Mater. Chem. A, 46 (2017) 5.
- Performance Optimization and Single Parabolic Band Behavior of Thermoelectric $\mathrm{MnTe}$ , J. Mater. Chem. A, 36 (2017) 5.