Zhaokun
3 records found
1
Authored
We developed a dedicated computational framework by coupling the lattice-Boltzmann-method (LBM) modeling and the particle-swarm-optimization (PSO) algorithm to search optimal strategies of magnetic nanoparticle (MNP) injection for hyperthermia-based cancer treatment. Two simpl ...
For the relevant properties of pristine and doped (Si, P, Se, Te, As) monolayer WS2 before and after the adsorption of CO, CO2, N2, NO, NO2 and O2, density functional theory (DFT) calculations are made. Calculation results ...
A DFT study of As doped WSe2
A NO2 sensing material with ultra-high selectivity in the atmospheric environment
In this work, the adsorption of toxic gaseous NO2 and other gas molecules (NO, CO, CO2, N2, O2, SO2) on pristine and X-doped (X = Si, P, S, Te, As) two-dimensional (2D) WSe2 have been detailed studied by perform ...