화학공학소재연구정보센터
검색결과 : 21건
No. Article
1 BH4 dissociation on various metal (111) surfaces: A DFT study
Akca A, Genc AE, Kutlu B
Applied Surface Science, 473, 681, 2019
2 Dissociation mechanism of HFC-245fa on Cu(111) surfaces with and without oxygen-covered: A density functional theory study
Huo EG, Liu C, Xu XX, Liu L, Wang SK
Applied Surface Science, 480, 487, 2019
3 Insight into the promotion effect of pre-covered X (C, N and O) atoms on the dissociation of water on Cu(111) surface: A DFT study
Jiang Z, Fang T
Applied Surface Science, 376, 219, 2016
4 A DFT study on the Cu (111) surface for ethyl acetate synthesis from ethanol dehydrogenation
Li RZ, Zhang MH, Yu YZ
Applied Surface Science, 258(18), 6777, 2012
5 Surface diffusion coefficient determination by uniaxial tensile strain in Pb/Cu(111) surface systems
Choi H, Lee EK, Chung YC
Current Applied Physics, 11(3), S400, 2011
6 On the importance of long range summation of oscillatory interactions in Monte Carlo modeling
Rogowska JM
Applied Surface Science, 254(14), 4370, 2008
7 Anisotropic diffusion of Cu adatoms on strained Cu (111) surface
Wang YX, Pan ZY, Liu TJ, Jiang XM, Zhou L, Zhu J
Applied Surface Science, 253(4), 1748, 2006
8 Mechanism and cross sections for HD and CH4-xDx (x=1-4) formation in D(g)+CH3/Cu(111) reaction at 100 K
Kim JY, Lee J
Journal of Chemical Physics, 112(13), 6015, 2000
9 Dissociative adsorption of H-2 on Cu(100) : Fixed-site calculations for impact at hollow and top sites
Mowrey RC, Kroes GJ, Baerends EJ
Journal of Chemical Physics, 108(16), 6906, 1998
10 Dissociative Adsorption of H-2 on Cu(100) - A 4-Dimensional Study of the Effect of Rotational Motion on the Reaction Dynamics
Mowrey RC, Kroes GJ, Wiesenekker G, Baerends EJ
Journal of Chemical Physics, 106(10), 4248, 1997