김종윤 교수 연구실
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·2026
The effect of temperature, pressure, and H2O coverage on surface stability of cubic HfO2 (111) using ab initio thermodynamics
Saroj Thapa, Jong-Yoon Kim, H.T. Kim, Jun-Yeong Jo, Yeong-Cheol Kim
Computational Materials Science
키워드
AdsorptionPhase diagramAb initioChemical stabilityGibbs free energyCharge densityAb initio quantum chemistry methods