UF3 MLIP for MoS2 reproduces DFT properties with high fidelity and simulates layered homoepitaxial growth showing van der Waals gaps and zigzag-bounded triangular domains.
(5) Dong, J.; Zhang, L.; Dai, X.; Ding, F
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Machine-Learned Interatomic Potential for Predictive Simulation of MoS2 Epitaxy
UF3 MLIP for MoS2 reproduces DFT properties with high fidelity and simulates layered homoepitaxial growth showing van der Waals gaps and zigzag-bounded triangular domains.