no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
1 |
Ab initio phonon dispersion calculations for Ti x Ga n As m and Ti xGanPm compounds
|
Palacios, P. |
|
2005 |
33 |
1-3 |
p. 118-124 7 p. |
article |
2 |
Ab initio simulations on AgCl(111) surface and AgCl(111)/α-Al2O3(0001) interface
|
Zhukovskii, Yu.F. |
|
2005 |
33 |
1-3 |
p. 276-281 6 p. |
article |
3 |
A methodology for the kinetic Monte Carlo simulation of alumina atomic layer deposition onto silicon
|
Mazaleyrat, G. |
|
2005 |
33 |
1-3 |
p. 74-82 9 p. |
article |
4 |
An ab initio study of titanium tetra-iso-propoxide (TTIP) adsorption mechanism on a Si(100) surface
|
Palma, Amedeo |
|
2005 |
33 |
1-3 |
p. 244-249 6 p. |
article |
5 |
A novel technique for the structural and energetic characterization of lattice defects in the molecular dynamics framework
|
Marqués, Luis A. |
|
2005 |
33 |
1-3 |
p. 112-117 6 p. |
article |
6 |
Application of X-ray standing wave (XSW) technique for studies of Zn incorporation in InP epilayers
|
Sirenko, A.A. |
|
2005 |
33 |
1-3 |
p. 132-135 4 p. |
article |
7 |
A Tight Binding study of defects in nanocrystalline SnO2
|
Mazzone, A.M. |
|
2005 |
33 |
1-3 |
p. 346-350 5 p. |
article |
8 |
Atomistic modeling of dopant implantation and annealing in Si: damage evolution, dopant diffusion and activation
|
Pelaz, Lourdes |
|
2005 |
33 |
1-3 |
p. 92-105 14 p. |
article |
9 |
Atomistic modelling of processes involved in poling of PVDF
|
Ramos, Marta M.D. |
|
2005 |
33 |
1-3 |
p. 230-236 7 p. |
article |
10 |
Carbon nanotube shuttle memory device based on singlewall-to-doublewall carbon nanotube transition
|
Kang, Jeong Won |
|
2005 |
33 |
1-3 |
p. 338-345 8 p. |
article |
11 |
Characterisation of oxide dispersion-strengthened steel by extended X-ray absorption spectroscopy for its use under irradiation
|
Degueldre, C. |
|
2005 |
33 |
1-3 |
p. 3-12 10 p. |
article |
12 |
Characterization and depth profiles measurements of silicon nitride thin films on silicon and molybdenum substrates by Auger electron spectroscopy
|
Fakih, Chakib |
|
2005 |
33 |
1-3 |
p. 395-399 5 p. |
article |
13 |
Comparative study of the monolayers A3 Si(CH2) n OCOCH3 (A=Cl,OH) adsorpted on silica surface
|
Dkhissi, A. |
|
2005 |
33 |
1-3 |
p. 282-286 5 p. |
article |
14 |
Cu-alkali ion exchange in glass: a model for the copper diffusion based on XAFS experiments
|
Gonella, F. |
|
2005 |
33 |
1-3 |
p. 31-36 6 p. |
article |
15 |
Density functional theory investigation of molecular oxygen interacting with Si(100)-(2×1)
|
Richard, N. |
|
2005 |
33 |
1-3 |
p. 26-30 5 p. |
article |
16 |
Dipole alignment and dielectric susceptibility of defective ferroelectric: Monte-Carlo simulation
|
Liu, J.-M. |
|
2005 |
33 |
1-3 |
p. 66-73 8 p. |
article |
17 |
Editorial board
|
|
|
2005 |
33 |
1-3 |
p. CO2- 1 p. |
article |
18 |
Effect of ion irradiation on the structural formation of aluminide phases on the Ti substrate during annealing
|
Romankov, S.E. |
|
2005 |
33 |
1-3 |
p. 388-394 7 p. |
article |
19 |
Effect of tungsten 0–8wt.% on the oxidation of Co–Cr alloys
|
Karaali, A. |
|
2005 |
33 |
1-3 |
p. 37-43 7 p. |
article |
20 |
Elastic properties of binary NiAl, NiCr and AlCr and ternary Ni2AlCr alloys from molecular dynamic and Abinitio simulation
|
Faraoun, H. |
|
2005 |
33 |
1-3 |
p. 184-191 8 p. |
article |
21 |
Electronic control of the stability of rutile- versus corundum-type structures of ruthenium and rhodium oxides
|
Grillo, M.E. |
|
2005 |
33 |
1-3 |
p. 83-91 9 p. |
article |
22 |
E-MRS 2004 Spring Meeting Symposium H: Atomic Scale Materials Design: Modelling and Characterization
|
Estève, Alain |
|
2005 |
33 |
1-3 |
p. 1-2 2 p. |
article |
23 |
Evolution of nanometric structures under irradiation studied by a time-dependent Hartree–Fock method
|
Morandi, V. |
|
2005 |
33 |
1-3 |
p. 351-355 5 p. |
article |
24 |
First principles calculations of structural, elastic and electronic properties of XO2 (X=Zr, Hf and Th) in fluorite phase
|
Terki, R. |
|
2005 |
33 |
1-3 |
p. 44-52 9 p. |
article |
25 |
First principles calculation study of multi-silicon doped fullerenes
|
Matsubara, Masahiko |
|
2005 |
33 |
1-3 |
p. 237-243 7 p. |
article |
26 |
First principles modeling of intermediate range order in amorphous SiSe2
|
Celino, Massimo |
|
2005 |
33 |
1-3 |
p. 106-111 6 p. |
article |
27 |
First-principles study of cubic Al x Ga1−x N alloys
|
Dridi, Z. |
|
2005 |
33 |
1-3 |
p. 136-140 5 p. |
article |
28 |
First stages of the oxidation of the Si-rich 3C–SiC(001) surface
|
Wachowicz, E. |
|
2005 |
33 |
1-3 |
p. 13-19 7 p. |
article |
29 |
FP-LAPW investigation of electronic structure of TaN and TaC compounds
|
Sahnoun, M. |
|
2005 |
33 |
1-3 |
p. 175-183 9 p. |
article |
30 |
Growth of three-dimensional SiC clusters on Si modelled by KMC
|
Schmidt, A.A. |
|
2005 |
33 |
1-3 |
p. 375-381 7 p. |
article |
31 |
Half-metallic Mn-doped Si(x)Ge(1− x) alloys: a first principles study
|
Peressi, M. |
|
2005 |
33 |
1-3 |
p. 125-131 7 p. |
article |
32 |
Intra-molecular properties of DMeOPPV studied by quantum molecular dynamics
|
Correia, Helena M.G. |
|
2005 |
33 |
1-3 |
p. 218-223 6 p. |
article |
33 |
Investigation of sputtering and oxygen desorption processes by binary collision approximation method
|
Dzhurakhalov, A.A. |
|
2005 |
33 |
1-3 |
p. 250-255 6 p. |
article |
34 |
Kinetics of diffusion-limited reactions with biased diffusion in percolating to compact substrates
|
Gonçalves, N.J. |
|
2005 |
33 |
1-3 |
p. 331-337 7 p. |
article |
35 |
Local vibrational modes of Zn–H–As defects in GaAs, ZnSe and ZnTe
|
Torres, V.J.B. |
|
2005 |
33 |
1-3 |
p. 145-147 3 p. |
article |
36 |
L10-ordering kinetics in FePt nano-layers: Monte Carlo simulation
|
Kozłowski, M. |
|
2005 |
33 |
1-3 |
p. 287-295 9 p. |
article |
37 |
Low-energy P+ ion channeling and implantation into Si(110), SiC(110), GaP(110) and GaAs(110)
|
Rasulov, A.M. |
|
2005 |
33 |
1-3 |
p. 148-152 5 p. |
article |
38 |
Measurement of attraction force between AFM tip and surface of dielectric thin films with DC-bias
|
Zhu, Y.F. |
|
2005 |
33 |
1-3 |
p. 53-58 6 p. |
article |
39 |
Modeling current transport in organic light-emitting devices (OLEDs)
|
Kwok, H.L. |
|
2005 |
33 |
1-3 |
p. 200-205 6 p. |
article |
40 |
Modeling the optical properties of Si-capped germanium quantum dots
|
Skoulidis, N. |
|
2005 |
33 |
1-3 |
p. 303-309 7 p. |
article |
41 |
Modelling of a selforganization process leading to periodic arrays of nanometric amorphous precipitates by ion irradiation
|
Zirkelbach, F. |
|
2005 |
33 |
1-3 |
p. 310-316 7 p. |
article |
42 |
Modelling of layer epitaxial growth: surface morphology and growth mode transitions
|
Trofimov, Vladimir I. |
|
2005 |
33 |
1-3 |
p. 362-368 7 p. |
article |
43 |
Molecular dynamics simulations of nanomemory element based on boron-nitride nanotube-to-peapod transition
|
Hwang, Ho Jung |
|
2005 |
33 |
1-3 |
p. 317-324 8 p. |
article |
44 |
Monte Carlo growth and in situ characterisation for Al x Ga1−x As heteroepitaxy
|
Fazouan, N. |
|
2005 |
33 |
1-3 |
p. 382-387 6 p. |
article |
45 |
Nanoscale effects on the nanomechanical properties of multifunctional materials
|
Charitidis, C. |
|
2005 |
33 |
1-3 |
p. 296-302 7 p. |
article |
46 |
Numerical modeling of the superconducting flux flow transistor with a nanobridge
|
Ko, Seokcheol |
|
2005 |
33 |
1-3 |
p. 325-330 6 p. |
article |
47 |
Numerical simulation of metallic film thickness distribution deposited by electron beam co-evaporation under vacuum
|
Aubreton, P. |
|
2005 |
33 |
1-3 |
p. 400-406 7 p. |
article |
48 |
One-dimensional electron systems for anchoring growth of carbon nanostructures
|
Hyldgaard, P. |
|
2005 |
33 |
1-3 |
p. 356-361 6 p. |
article |
49 |
Ordering effects on the electronic structures of AlN/GaN, InN/GaN and InN/AlN superlattices
|
Lakdja, A. |
|
2005 |
33 |
1-3 |
p. 157-162 6 p. |
article |
50 |
Phase separation and magnetoresistance in random-field magnetic polaron systems
|
Dong, Sh. |
|
2005 |
33 |
1-3 |
p. 168-174 7 p. |
article |
51 |
Predictive process design: a theoretical model of atomic layer deposition
|
Elliott, Simon D. |
|
2005 |
33 |
1-3 |
p. 20-25 6 p. |
article |
52 |
Quantitative characterization of the mesoscopic surface roughness in a growing island film
|
Trofimov, Vladimir I. |
|
2005 |
33 |
1-3 |
p. 369-374 6 p. |
article |
53 |
Quantum modelling of poly(vinylidene fluoride)
|
Correia, Helena M.G. |
|
2005 |
33 |
1-3 |
p. 224-229 6 p. |
article |
54 |
Quenching-dependent reversible modification of electronic structure of proton-implanted silicon
|
Tokmoldin, S. |
|
2005 |
33 |
1-3 |
p. 141-144 4 p. |
article |
55 |
Relaxation of open crystal structures with a density functional tight-binding scheme: Illustration in the case of the acetonitrile crystal
|
Beaucamp, Sylvain |
|
2005 |
33 |
1-3 |
p. 212-217 6 p. |
article |
56 |
Rf-sputtering deposition and magnetic characterisation of Nd–Fe–B thin films for microwave applications
|
Valetas, M. |
|
2005 |
33 |
1-3 |
p. 163-167 5 p. |
article |
57 |
Spin polarization and band alignments at NiMnSb/GaAs interface
|
Debernardi, A. |
|
2005 |
33 |
1-3 |
p. 263-268 6 p. |
article |
58 |
Stability in polysilanes for light emitting diodes
|
Sharma, Asha |
|
2005 |
33 |
1-3 |
p. 206-211 6 p. |
article |
59 |
Structural properties and stability of defected ZnSe/GaAs(001) interfaces
|
Stroppa, A. |
|
2005 |
33 |
1-3 |
p. 256-262 7 p. |
article |
60 |
The local inelastic electron–polar optical phonon interaction in mercury telluride
|
Malyk, O.P. |
|
2005 |
33 |
1-3 |
p. 153-156 4 p. |
article |
61 |
Three-step mechanism of the water recombination reactions on SiO2/Si surface in the first stage of ZrO2 atomic layer deposition
|
Jeloaica, L. |
|
2005 |
33 |
1-3 |
p. 59-65 7 p. |
article |
62 |
Tight binding modeling of band gaps and band offsets in heterostructures
|
Hakan Gürel, H. |
|
2005 |
33 |
1-3 |
p. 269-275 7 p. |
article |
63 |
Van der Waals interaction of parallel polymers and nanotubes
|
Kleis, Jesper |
|
2005 |
33 |
1-3 |
p. 192-199 8 p. |
article |