화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Insight of DFT and ab initio atomistic thermodynamics on the surface stability and morphology of In2O3
Zhang MH, Wang WY, Chen YF
Applied Surface Science, 434, 1344, 2018
2 Adsorption and dissociation of H2O and CO2 on the clean and O-pre-covered Ru(0001) surface
Zhao P, He YR, Liu SL, Cao DB, Wen XD, Xiang HW, Li YW, Jiao HJ
Applied Catalysis A: General, 540, 31, 2017
3 Co-adsorption and mutual interaction of nCO plus mH(2) on the Fe(110) and Fe(111) surfaces
Wang T, Tian XX, Yang Y, Li YW, Wang JG, Beller M, Jiao HJ
Catalysis Today, 261, 82, 2016
4 Surface morphology of Hagg iron carbide (chi-Fe5C2) from ab initio atomistic thermodynamics
Zhao S, Liu XW, Huo CF, Li YW, Wang JG, Jiao HJ
Journal of Catalysis, 294, 47, 2012
5 Surface processes and phase transitions from ab initio atomistic thermodynamics and statistical mechanics
Stampfl C
Catalysis Today, 105(1), 17, 2005