nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
A data-driven identification of morphological features influencing the fill factor and efficiency of organic photovoltaic devices
|
Gebhardt, Ryan S. |
|
2017 |
129 |
C |
p. 220-225 6 p. |
artikel |
2 |
A DFT study on the modification mechanism of (Cr, C) co-doping for the electronic and optical properties of anatase TiO2
|
Li, Xuechao |
|
2017 |
129 |
C |
p. 295-303 9 p. |
artikel |
3 |
An interatomic potential for simulation of Zr-Nb system
|
Smirnova, D.E. |
|
2017 |
129 |
C |
p. 259-272 14 p. |
artikel |
4 |
A novel temperature dependent yield strength model for metals considering precipitation strengthening and strain rate
|
Zhang, Xianhe |
|
2017 |
129 |
C |
p. 147-155 9 p. |
artikel |
5 |
A paramagnetic neutral CBVN center in hexagonal boron nitride monolayer for spin qubit application
|
Cheng, G.D. |
|
2017 |
129 |
C |
p. 247-251 5 p. |
artikel |
6 |
A study of adatom ripening on an Al (111) surface with machine learning force fields
|
Botu, V. |
|
2017 |
129 |
C |
p. 332-335 4 p. |
artikel |
7 |
Changes in micromechanical properties of Na-montmorillonite caused by CO2/H2O sorption
|
Zhang, W.N. |
|
2017 |
129 |
C |
p. 178-183 6 p. |
artikel |
8 |
Concurrent topology optimization of composite macrostructure and microstructure constructed by constituent phases of distinct Poisson's ratios for maximum frequency
|
Long, Kai |
|
2017 |
129 |
C |
p. 194-201 8 p. |
artikel |
9 |
Doping of graphene using ion beam irradiation and the atomic mechanism
|
Wu, Xin |
|
2017 |
129 |
C |
p. 184-193 10 p. |
artikel |
10 |
Effect of grain size on apparent diffusivity in nanocrystal α-iron by atomistic simulation
|
Mohammadzadeh, Mina |
|
2017 |
129 |
C |
p. 239-246 8 p. |
artikel |
11 |
Effects of dispersion and orientation of nanorods on electrical networks of block copolymer nanocomposites
|
Zhang, Shuaichao |
|
2017 |
129 |
C |
p. 107-114 8 p. |
artikel |
12 |
Electrocaloric effect in PbZrO3 thin films with antiferroelectric-ferroelectric phase competition
|
Glazkova-Swedberg, E. |
|
2017 |
129 |
C |
p. 44-48 5 p. |
artikel |
13 |
Electronic structure and oxygen reduction on tunable [Ti(IV)Pc]2+ and Ti(II)Pc titanyl-phthalocyanines: A quantum chemical prediction
|
De Lile, Jeffrey Roshan |
|
2017 |
129 |
C |
p. 24-36 13 p. |
artikel |
14 |
FEM analysis of metal matrix nanocomposites reinforced with off-line atomistically-informed equivalent nanofillers
|
Bashirvand, S. |
|
2017 |
129 |
C |
p. 89-97 9 p. |
artikel |
15 |
First-principles calculations for the mechanical properties of Ti-Nb-B2 solid solutions
|
Mediukh, N.R. |
|
2017 |
129 |
C |
p. 82-88 7 p. |
artikel |
16 |
Hydrogenation-induced giant rectifying behaviors in silicene and germanene heterojunctions
|
Song, Yang |
|
2017 |
129 |
C |
p. 37-43 7 p. |
artikel |
17 |
IFC
|
|
|
2017 |
129 |
C |
p. IFC- 1 p. |
artikel |
18 |
Influence of point defects on optical properties of GaN-based materials by first principle study
|
Li, Linsen |
|
2017 |
129 |
C |
p. 49-54 6 p. |
artikel |
19 |
Influence of surface atomic structure on the mechanical response of aluminum nanospheres under compression
|
Bel Haj Salah, S. |
|
2017 |
129 |
C |
p. 273-278 6 p. |
artikel |
20 |
Interatomic potential that describes martensitic phase transformations in pure lithium
|
Ko, Won-Seok |
|
2017 |
129 |
C |
p. 202-210 9 p. |
artikel |
21 |
Magnetism and magnetocrystalline anisotropy in vacancy doped and (non)metal adsorbed single-layer PtSe2
|
Zhang, Wei |
|
2017 |
129 |
C |
p. 171-177 7 p. |
artikel |
22 |
Mechanical behavior of planar borophenes: A molecular mechanics study
|
Giannopoulos, Georgios I. |
|
2017 |
129 |
C |
p. 304-310 7 p. |
artikel |
23 |
Mechanical behaviors of nanocrystalline Cu/SiC composites: An atomistic investigation
|
Zhou, Yanguang |
|
2017 |
129 |
C |
p. 129-136 8 p. |
artikel |
24 |
Mesoscopic coupled modeling of texture formation during recrystallization considering stored energy decomposition
|
Kim, Dong-Kyu |
|
2017 |
129 |
C |
p. 55-65 11 p. |
artikel |
25 |
Mg fragments and Al bonded networks in liquid Mg–Al alloys
|
Wang, Jin |
|
2017 |
129 |
C |
p. 115-122 8 p. |
artikel |
26 |
Molecular dynamics sliding simulations of amorphous Ni, Ni-P and nanocrystalline Ni films
|
Dmitriev, Andrey I. |
|
2017 |
129 |
C |
p. 231-238 8 p. |
artikel |
27 |
Molecular dynamics study of fracture toughness and trans-intergranular transition in bi-crystalline graphene
|
Han, Jihoon |
|
2017 |
129 |
C |
p. 323-331 9 p. |
artikel |
28 |
Monte Carlo simulations of polycrystalline ferroelectrics: Effects of electric field and grain size on dynamic electric polarization
|
Allen, J.B. |
|
2017 |
129 |
C |
p. 164-170 7 p. |
artikel |
29 |
Multi-fidelity machine learning models for accurate bandgap predictions of solids
|
Pilania, G. |
|
2017 |
129 |
C |
p. 156-163 8 p. |
artikel |
30 |
Multi-scale modelling of carbon nanotube reinforced crosslinked interfaces
|
Ozden-Yenigun, Elif |
|
2017 |
129 |
C |
p. 279-289 11 p. |
artikel |
31 |
Optimal experimental design for materials discovery
|
Dehghannasiri, Roozbeh |
|
2017 |
129 |
C |
p. 311-322 12 p. |
artikel |
32 |
Phase-field study on effects of antiphase domain and elastic energy on evolution of γ′ precipitates in nickel-based superalloys
|
Yang, M. |
|
2017 |
129 |
C |
p. 211-219 9 p. |
artikel |
33 |
Plastic deformation mechanisms and size effect of Cu50Zr50/Cu amorphous/crystalline nanolaminate: A molecular dynamics study
|
Luan, Y.W. |
|
2017 |
129 |
C |
p. 137-146 10 p. |
artikel |
34 |
Self-diffusion in intermetallic AlAu4: Molecular dynamics study down to temperatures relevant to wire bonding
|
Guerdane, M. |
|
2017 |
129 |
C |
p. 13-23 11 p. |
artikel |
35 |
Simulation analysis of co-continuous ceramic composite dynamic mechanical performance and optimization design
|
Wang, Qingxiang |
|
2017 |
129 |
C |
p. 123-128 6 p. |
artikel |
36 |
Simulations of cratering and sputtering from an ion track in crystalline and amorphous Lennard Jones thin films
|
Gutierres, L.I. |
|
2017 |
129 |
C |
p. 98-106 9 p. |
artikel |
37 |
Strengthening materials by changing the number of valence electrons
|
Xing, Wandong |
|
2017 |
129 |
C |
p. 252-258 7 p. |
artikel |
38 |
The electronic properties of chiral carbon nanotubes
|
Liu, Jing |
|
2017 |
129 |
C |
p. 290-294 5 p. |
artikel |
39 |
Thermal conductivity of 1D carbyne chains
|
Deng, Yichen |
|
2017 |
129 |
C |
p. 226-230 5 p. |
artikel |
40 |
Uniaxial deformation of polystyrene–silica nanocomposites studied by hybrid molecular dynamics–finite element simulations
|
Liu, Shengyuan |
|
2017 |
129 |
C |
p. 1-12 12 p. |
artikel |
41 |
Using Bayesian framework to calibrate a physically based model describing strain-stress behavior of TRIP steels
|
Honarmandi, P. |
|
2017 |
129 |
C |
p. 66-81 16 p. |
artikel |