activity
20182023
most citedPd/Pt embedded CN monolayer as efficient catalysts for CO oxidation

23 citations · 39 across the 3 of their papers we have counts for

collaborators

5 papers

cond-mat.mtrl-sci2023★ 3 cited

Large modulation of thermal transport in 2D semimetal triphosphides by doping-induced electron-phonon coupling

Yongchao Rao, C. Y. Zhao, Lei Shen +1

Recent studies demonstrate that novel 2D triphosphides semiconductors possess high carrier mobility and promising thermoelectric performance, while the carrier transport behaviors…

cond-mat.mtrl-sci2022★ 13 cited

High thermoelectric performance in metastable phase of silicon: a first-principles study

Yongchao Rao, C. Y. Zhao, Shenghong Ju

In this work, both thermal and electrical transport properties of diamondcubic Si (SiI) and metastable R8 phase of Si (SiXII) are comparatively studied by using firstpr…

physics.chem-ph2019★ 23 cited

Pd/Pt embedded CN monolayer as efficient catalysts for CO oxidation

Yongchao Rao, Xiangmei Duan

Single atom catalysts (SACs) based on 2D materials are identified to be efficient in many catalytic reaction. In this work, the catalytic performance of Pd/Pt embedded planar carbo…

physics.comp-ph2018

Theoretical design of a strain-controlled nanoporous CN membrane for helium separation

Yongchao Rao, Zhaoqin Chu, Xiao Gu +1

Designing an efficient membrane for He purification is quite crucial in scientific and industrial applications. Ultrathin membranes with intrinsic pores are highly desirable for ga…

physics.comp-ph2018

Prediction of MoO2 as high capacity electrode material for (Na, K, Ca)-ion batteries

Yongchao Rao, Song Yu, Xiao Gu +1

Na, K and Ca-ion battery electrode materials with appropriate electrochemical properties are desirable candidates for replacing lithium-ion batteries (LIBs) because of their natura…