화학공학소재연구정보센터
검색결과 : 22건
No. Article
1 Off-Lattice Flory-Huggins Approximations for the Tailored Calculation of Activity Coefficients of Organic Solutes in Random and Block Copolymers
Nguyen PM, Guiga W, Dkhissi A, Vitrac O
Industrial & Engineering Chemistry Research, 56(3), 774, 2017
2 Introducing densification mechanisms into the modelling of HfO2 atomic layer deposition
Mastail C, Lanthony C, Olivier S, Ducere JM, Landa G, Esteve A, Rouhani MD, Richard N, Dkhissi A
Thin Solid Films, 520(14), 4559, 2012
3 First-principles study of near surface point defects stability in Si (100) and SiGe(100)
Fetah S, Chikouche A, Dkhissi A, Esteve A, Rouhani MD, Landa G, Pochet P
Thin Solid Films, 518(9), 2418, 2010
4 Metahybrid density functional theory and correlated ab initio studies on microhydrated adenine-thymine base pairs
Dkhissi A, Blossey R
Journal of Physical Chemistry B, 112(30), 9182, 2008
5 Electronic Structure and Optical Properties of Poly[3-(4-octylphenoxy)thiophene]: Experimental and Theoretical Studies
Ouhib F, Dkhissi A, Iratcabal P, Hiorns RC, Khoukh A, Desbrieres J, Pouchan C, Dagron-Lartigau C
Journal of Polymer Science Part A: Polymer Chemistry, 46(22), 7505, 2008
6 Performance of DFT/MPWB1K for stacking and H-bonding interactions
Dkhissi A, Blossey R
Chemical Physics Letters, 439(1-3), 35, 2007
7 Molecular mechanics study of the influence of the alkyl substituents on the packing of the conjugated PEDOT chains
Dkhissi A, Brocorens P, Lazzaroni R
Chemical Physics Letters, 432(1-3), 167, 2006
8 Self-assembled monolayers and preorganization of organosilanes prior to surface grafting onto silica: A quantum mechanical study
Dkhissi A, Esteve A, Jeloaica L, Esteve D, Rouhani MD
Journal of the American Chemical Society, 127(27), 9776, 2005
9 Spectroscopic studies of proton transfer in hydrogen bonding: adenine complexed to HCl
Dkhissi A, Houben L, Adamowicz L, Maes G
Chemical Physics Letters, 387(4-6), 362, 2004
10 Grafting of chains organo-silane on silica surface: a quantum chemical investigation
Dkhissi A, Esteve A, Jeloaica L, Esteve D, Rouhani MD
Chemical Physics Letters, 400(4-6), 353, 2004