| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
An ATPSO-BP neural network modeling and its application in mechanical property prediction
|
Zhang, Jian-ping
|
|
2019
|
163 |
C |
p. 262-266
|
artikel
|
| 2 |
Application of alloy solidification theory to cellular automata modeling of near-rapid constrained solidification
|
Rolchigo, M.R.
|
|
2019
|
163 |
C |
p. 148-161
|
artikel
|
| 3 |
Athermal mechanical analysis of Stone-Wales defects in two-dimensional silica
|
Bamer, Franz
|
|
2019
|
163 |
C |
p. 301-307
|
artikel
|
| 4 |
A vector-valued phase field model for polycrystalline solidification using operator splitting method
|
Ren, Jian-kun
|
|
2019
|
163 |
C |
p. 37-49
|
artikel
|
| 5 |
Behavior of water molecules between molecular layers of by-products of dicumyl peroxide or surfactants in an external electric field: Computational insight
|
Iwata, Shinya
|
|
2019
|
163 |
C |
p. 134-140
|
artikel
|
| 6 |
Coarse-grained molecular dynamics simulations of particle behaviors in magnetorheological polishing fluid
|
Xu, Jinhuan
|
|
2019
|
163 |
C |
p. 68-81
|
artikel
|
| 7 |
Combined molecular dynamics and phase-field modelling of crack propagation in defective graphene
|
Hansen-Dörr, Arne Claus
|
|
2019
|
163 |
C |
p. 117-126
|
artikel
|
| 8 |
Combined molecular dynamics and phase field simulation investigations of crystal-melt interfacial properties and dendritic solidification of highly undercooled titanium
|
Kavousi, Sepideh
|
|
2019
|
163 |
C |
p. 218-229
|
artikel
|
| 9 |
Constructing initial nanocrystalline configurations from phase field microstructures enables rational molecular dynamics simulation
|
Zhang, Meng
|
|
2019
|
163 |
C |
p. 162-166
|
artikel
|
| 10 |
Defect energy levels and persistent luminescence in Cu-doped ZnS
|
Hoang, Khang
|
|
2019
|
163 |
C |
p. 63-67
|
artikel
|
| 11 |
Development of the interatomic potentials for W-Ta system
|
Chen, Yangchun
|
|
2019
|
163 |
C |
p. 91-99
|
artikel
|
| 12 |
DFT calculations of metal-organic I-III-VI semiconductor clusters: Benchmark of exchange-correlation functionals and localized basis sets
|
Olejniczak, Adam
|
|
2019
|
163 |
C |
p. 186-195
|
artikel
|
| 13 |
Editorial Board
|
|
|
2019
|
163 |
C |
p. ii
|
artikel
|
| 14 |
Effect of tool edge radius on material removal mechanism of single-crystal silicon: Numerical and experimental study
|
Liu, Bing
|
|
2019
|
163 |
C |
p. 127-133
|
artikel
|
| 15 |
Effects of electronic structures on mechanical properties of transition metals and alloys
|
Qi, Liang
|
|
2019
|
163 |
C |
p. 11-16
|
artikel
|
| 16 |
Enhanced photocatalytic activity of single-layered Hittorf’s violet phosphorene by isoelectronic doping and mechanical strain: A first-principles research
|
Lu, Yi-Lin
|
|
2019
|
163 |
C |
p. 209-217
|
artikel
|
| 17 |
Evolution of solidification defects in deformation of nano-polycrystalline aluminum
|
Mahata, Avik
|
|
2019
|
163 |
C |
p. 176-185
|
artikel
|
| 18 |
Finding the needle in the haystack: Materials discovery and design through computational ab initio high-throughput screening
|
Hautier, Geoffroy
|
|
2019
|
163 |
C |
p. 108-116
|
artikel
|
| 19 |
First-principles calculation of influence of nitrogen substituting for oxygen on the crystal structures and electronic band structures of Sr3MgSi2O8-σNσ
|
Zhang, Meng
|
|
2019
|
163 |
C |
p. 256-261
|
artikel
|
| 20 |
Graphyne as the anode material of magnesium-ion batteries: Ab initio study
|
Shomali, E.
|
|
2019
|
163 |
C |
p. 315-319
|
artikel
|
| 21 |
GRATE: A framework and software for GRaph based Analysis of Transmission Electron Microscopy images of polymer films
|
Pokuri, Balaji Sesha Sarath
|
|
2019
|
163 |
C |
p. 1-10
|
artikel
|
| 22 |
Hybrid Monte Carlo – Finite element simulation of microstructural evolution during annealing of severely deformed Sn-5Sb alloy
|
Vafaeenezhad, H.
|
|
2019
|
163 |
C |
p. 196-208
|
artikel
|
| 23 |
Incorporating hydrogen in mesoscale models
|
Tarleton, Edmund
|
|
2019
|
163 |
C |
p. 282-289
|
artikel
|
| 24 |
Influence of bulk free energy density on single void evolution based on the phase-field method
|
Li, Yang
|
|
2019
|
163 |
C |
p. 100-107
|
artikel
|
| 25 |
Interstitial triggered grain boundary embrittlement of Al–X (X = H, N and O)
|
Wang, William Yi
|
|
2019
|
163 |
C |
p. 241-247
|
artikel
|
| 26 |
Low-energy channel for mass transfer in Pt crystal initiated by molecule impact
|
Babicheva, Rita I.
|
|
2019
|
163 |
C |
p. 248-255
|
artikel
|
| 27 |
MatCALO: Knowledge-enabled machine learning in materials science
|
Picklum, Mareike
|
|
2019
|
163 |
C |
p. 50-62
|
artikel
|
| 28 |
Mechanical behavior of CuZr dual-phase nanocrystal-metallic glass composites
|
Sun, Pei
|
|
2019
|
163 |
C |
p. 290-300
|
artikel
|
| 29 |
Molecular dynamics simulations of helium clustering and bubble growth under tungsten surfaces
|
Hamid, Ali Y.
|
|
2019
|
163 |
C |
p. 141-147
|
artikel
|
| 30 |
New insights into the microstructures and mechanical responses of large-scale colliding aluminum nanospheres
|
Ma, Bo
|
|
2019
|
163 |
C |
p. 167-175
|
artikel
|
| 31 |
pyiron: An integrated development environment for computational materials science
|
Janssen, Jan
|
|
2019
|
163 |
C |
p. 24-36
|
artikel
|
| 32 |
Single-layer Ag6S2: First principles investigation of a new two-dimensional direct bandgap semiconductor
|
Ersan, Fatih
|
|
2019
|
163 |
C |
p. 278-281
|
artikel
|
| 33 |
Solvent effect on the formation of NTO/TZTN cocrystal explosives
|
Liu, Yi
|
|
2019
|
163 |
C |
p. 308-314
|
artikel
|
| 34 |
Structural and electronic properties of bulk and ultrathin layers of V2O5 and MoO3
|
Das, Tilak
|
|
2019
|
163 |
C |
p. 230-240
|
artikel
|
| 35 |
Superlubricity achieved for commensurate sliding: MoS2 frictional anisotropy in silico
|
Claerbout, Victor E.P.
|
|
2019
|
163 |
C |
p. 17-23
|
artikel
|
| 36 |
The electronic properties and magnetic states of edge-modified γ-graphdiyne nanoribbons
|
Li, Linwei
|
|
2019
|
163 |
C |
p. 82-90
|
artikel
|
| 37 |
The potential application of 2D Ti2CT2 (T = C, O and S) monolayer MXenes as anodes for Na-ion batteries: A theoretical study
|
Xiao, Yi
|
|
2019
|
163 |
C |
p. 267-277
|
artikel
|
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