Yiheng Yin

TL;DR: In this article, a rational and creative density-functional-theory-based, machine-learning-accelerated (DFT-ML) method was used to investigate the CO2RR catalytic activity of hundreds of transition metal phthalocyanine (Pc) DMSCs.

TL;DR: Analyses of electronic structures and charge transport calculations indicate a potential application of the 2D Ga2O3 monolayer as a room-temperature NO gas-sensing device with high sensitivity and tunable adsorption energy using plenary strain-induced lattice distortion.

TL;DR: This work calculated the anisotropic transport property of monolayer (ML) antimonene metal-oxide-semiconductor FET (MOSFETs), including on-state current, subthreshold swing, effective mass, intrinsic delay time and power dissipation and predicts that other transmission directions with effective masses can achieve ITRS HP goal, which enables antimonenes to be a promising channel material.

TL;DR: In this article, the authors conduct a co-conducting study on the gate-all-around (GAA) and nanowire (NW) technologies and show that they are the ultimate solutions to sustain Moore's law benefitting from the exceptional gate control ability.

TL;DR: In this article, a series of macrocyclic transition metal phthalocyanines (TMPc) and transition metal PHTHC absorbed oxygen or sulfur atoms (TMOPc and TMSPc), natural photocatalytic and electrocatalytic OER single-atom catalysts (SACs) are investigated.