| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A first-principles study on the structural stability and mechanical properties of TiZrVNbMo refractory high-entropy alloys
|
Lu, Chaoze
|
|
|
257 |
C |
p.
|
artikel
|
| 2 |
A semi-continuum multiscale model of graphene-based polymer nanocomposites: Mechanical characterization
|
Barakat, Malak
|
|
|
257 |
C |
p.
|
artikel
|
| 3 |
Assessing the critical cooling rate for glass formation by molecular dynamics and theoretical models
|
Separdar, Leila
|
|
|
257 |
C |
p.
|
artikel
|
| 4 |
Bayesian SegNet for semantic segmentation with improved interpretation of microstructural evolution during irradiation of materials
|
Oostrom, Marjolein
|
|
|
257 |
C |
p.
|
artikel
|
| 5 |
Clustering analysis to identify structural and density heterogeneity in Mg2SiO4 glass
|
Pham, Dung Tri
|
|
|
257 |
C |
p.
|
artikel
|
| 6 |
Comment on “High pressure structural, elastic, mechanical and thermal behavior of LaX3 (X = In, Sn, Tl and Pb) compounds: A FP-LAPW study” [Computational Materials Science 81 (2014) 423–432; http://dx.doi.org/10.1016/j.commatsci.2013.08.052]
|
Yadav, Dheerendra Singh
|
|
|
257 |
C |
p.
|
artikel
|
| 7 |
Crystal growth and residual stress of α-Al2O3 film deposited on α-Cr2O3 template: Molecular dynamics study
|
Luo, Yingzhi
|
|
|
257 |
C |
p.
|
artikel
|
| 8 |
Design and evaluation of Dopamine-incorporated polyurethane binder for TKX-50 explosives
|
Wu, Nan
|
|
|
257 |
C |
p.
|
artikel
|
| 9 |
Editorial Board
|
|
|
|
257 |
C |
p.
|
artikel
|
| 10 |
Effects of scandium doping on the oxygen diffusion barrier in monoclinic ZrO2 solid electrolyte: A density functional theory approach
|
Ahmadzadeh, MohammadAli
|
|
|
257 |
C |
p.
|
artikel
|
| 11 |
Evaluating the chemical kinetics of aluminium/alumina/water reactions using molecular dynamics
|
Zhao, Hao
|
|
|
257 |
C |
p.
|
artikel
|
| 12 |
First-principles prediction of the structure and stability of boron-carbon clusters
|
Fedyaeva, Maria
|
|
|
257 |
C |
p.
|
artikel
|
| 13 |
First-principles study of the phonon properties, Born effective charges, dielectric tensor, and thermodynamic properties of the fergusonite and scheelite phases of LaNbO4
|
Tartaglia, R.
|
|
|
257 |
C |
p.
|
artikel
|
| 14 |
From coarse-grained molecular dynamics to machine learning: A comparative study of modeling techniques for predicting polycarbonate maximum stress from structural features
|
Leelaprachakul, Tatchaphon
|
|
|
257 |
C |
p.
|
artikel
|
| 15 |
From empirical to machine learning potentials: Unraveling the physical properties of grapheneplus —A novel half-auxetic 2D carbon nanosheet
|
Alavi, Farzad
|
|
|
257 |
C |
p.
|
artikel
|
| 16 |
Mechanistic insights into early stages of iron corrosion under electrochemical conditions: A DFT study
|
Arachchige, Lakshitha Jasin
|
|
|
257 |
C |
p.
|
artikel
|
| 17 |
Misfit dislocation network and mechanical behaviour of Fe/TiN interface under uniaxial loading
|
Zhang, Lei
|
|
|
257 |
C |
p.
|
artikel
|
| 18 |
Molecular dynamics simulation of real paraffin wax melting points based on OPLS-AA force field parameter optimization
|
Liu, Jianyi
|
|
|
257 |
C |
p.
|
artikel
|
| 19 |
Neutral electride formed by d-orbital interactions in LiNbS2
|
Wang, Gui
|
|
|
257 |
C |
p.
|
artikel
|
| 20 |
New molecular dynamics studies of hydrogen effects on cross-slip energy barriers in austenitic stainless steels
|
Zhou, X.W.
|
|
|
257 |
C |
p.
|
artikel
|
| 21 |
Predicting random packing and thermophysical properties of powders using Monte Carlo simulation
|
Lucia, Angelo
|
|
|
257 |
C |
p.
|
artikel
|
| 22 |
Pressure-induced phase-transition to Chern insulating state of IA-Mn-VA compounds
|
Chavari, Amin
|
|
|
257 |
C |
p.
|
artikel
|
| 23 |
Structural, electronic, magnetic and optical properties of rhombohedral (R3c) AlFeO3 perovskite: A spin-polarized first principles study
|
Singh, Abhay
|
|
|
257 |
C |
p.
|
artikel
|
| 24 |
Structure and strain state evolution under nanoindentation of Ag nanospheres by machine learning interatomic potential
|
Shan, Shuang
|
|
|
257 |
C |
p.
|
artikel
|
| 25 |
Theoretical insights into the interface performance of Ga2O3/ZnO heterostructure photodetectors driven by polarization and strains
|
Su, Jinhao
|
|
|
257 |
C |
p.
|
artikel
|
| 26 |
Transferable predictions of energetic and structural properties for refractory solid solution alloys across chemical compositions
|
Lupo Pasini, Massimiliano
|
|
|
257 |
C |
p.
|
artikel
|
| 27 |
Two-pulse laser-induced spall failure of (111) twist grain boundaries in Ni bicrystals
|
Isiet, Mewael
|
|
|
257 |
C |
p.
|
artikel
|
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