| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
AFLOWπ: A minimalist approach to high-throughput ab initio calculations including the generation of tight-binding hamiltonians
|
Supka, Andrew R.
|
|
2017
|
136 |
C |
p. 76-84
|
artikel
|
| 2 |
An effective constitutive model for polycrystalline ferroelectric ceramics: Theoretical framework and numerical examples
|
Tan, Wei Lin
|
|
2017
|
136 |
C |
p. 223-237
|
artikel
|
| 3 |
A numerical model coupling diffusion and grain growth in nanocrystalline materials
|
Zhao, Jingyi
|
|
2017
|
136 |
C |
p. 243-252
|
artikel
|
| 4 |
A phase field model coupled with pressure-effect-embedded thermodynamic modeling for describing microstructure and microsegregation in pressurized solidification of a ternary magnesium alloy
|
Shang, Shan
|
|
2017
|
136 |
C |
p. 264-270
|
artikel
|
| 5 |
Carbon nanotubes as reinforcement in composites: A review of the analytical, numerical and experimental approaches
|
Imani Yengejeh, Sadegh
|
|
2017
|
136 |
C |
p. 85-101
|
artikel
|
| 6 |
Continuum modeling of surface roughening in heteroepitaxial structures based on phase field theory
|
Wang, Liyuan
|
|
2017
|
136 |
C |
p. 109-117
|
artikel
|
| 7 |
Crack detection in lithium-ion cells using machine learning
|
Petrich, Lukas
|
|
2017
|
136 |
C |
p. 297-305
|
artikel
|
| 8 |
Data mining assisted materials design of layered double hydroxide with desired specific surface area
|
Hu, Biao
|
|
2017
|
136 |
C |
p. 29-35
|
artikel
|
| 9 |
Design and synthesis of biodegradable antiscalant based on MD simulation of antiscale mechanism: A case of itaconic acid-epoxysuccinate copolymer
|
Shi, Wenyan
|
|
2017
|
136 |
C |
p. 118-125
|
artikel
|
| 10 |
DFT study of the interactions of H2O, O2 and H2O+O2 with TiO2 (101) surface
|
Du, Zheng
|
|
2017
|
136 |
C |
p. 173-180
|
artikel
|
| 11 |
Effects of terminated atoms, porosity and drilling orientations on the band structure of porous silicon
|
Zhang, Kaiqi
|
|
2017
|
136 |
C |
p. 126-132
|
artikel
|
| 12 |
First-principle study of graphyne-like BN sheet: Electronic structure and optical properties
|
Zhang, Yanni
|
|
2017
|
136 |
C |
p. 12-19
|
artikel
|
| 13 |
First principle study of V-implantation in highly-doped silicon materials
|
García, Gregorio
|
|
2017
|
136 |
C |
p. 207-215
|
artikel
|
| 14 |
Frictional properties of multi-asperity surfaces at the nanoscale
|
Santhapuram, Raghuram R.
|
|
2017
|
136 |
C |
p. 253-263
|
artikel
|
| 15 |
Generating derivative superstructures for systems with high configurational freedom
|
Morgan, Wiley S.
|
|
2017
|
136 |
C |
p. 144-149
|
artikel
|
| 16 |
Generation of 3D polycrystalline microstructures with a conditioned Laguerre-Voronoi tessellation technique
|
Falco, Simone
|
|
2017
|
136 |
C |
p. 20-28
|
artikel
|
| 17 |
GPU-accelerated three-dimensional phase-field simulation of dendrite growth in a nickel-based superalloy
|
Yang, Cong
|
|
2017
|
136 |
C |
p. 133-143
|
artikel
|
| 18 |
IFC
|
|
|
2017
|
136 |
C |
p. IFC
|
artikel
|
| 19 |
Investigation on mechanical properties of polycrystalline W nanowire
|
Saha, Sourav
|
|
2017
|
136 |
C |
p. 52-59
|
artikel
|
| 20 |
Mechanical properties of penta-graphene, hydrogenated penta-graphene, and penta-CN2 sheets
|
Le, Minh-Quy
|
|
2017
|
136 |
C |
p. 181-190
|
artikel
|
| 21 |
Mechanical stability and superconductivity of PbO-type phase of thorium monocarbide at high pressure
|
Yan, Yan
|
|
2017
|
136 |
C |
p. 238-242
|
artikel
|
| 22 |
Mechanistic study of bending creep behaviour of bicrystal nanobeam
|
Vijay Reddy, K.
|
|
2017
|
136 |
C |
p. 36-43
|
artikel
|
| 23 |
Mixed-mode fracture toughness evaluation of a copper single crystal using atomistic simulations
|
Cui, Cheng Bin
|
|
2017
|
136 |
C |
p. 216-222
|
artikel
|
| 24 |
Modeling and simulation of dynamic recrystallization behaviors of magnesium alloy AZ31B using cellular automaton method
|
Chen, Ming-Song
|
|
2017
|
136 |
C |
p. 163-172
|
artikel
|
| 25 |
Modeling of spectral energy density as thermal radiation characteristic on the basis of porous silicon photonic crystals
|
Min-Dianey, Kossi Aniya Amedome
|
|
2017
|
136 |
C |
p. 306-314
|
artikel
|
| 26 |
Modeling of the bivariate molecular weight distribution-copolymer composition distribution in RAFT copolymerization using probability generating functions
|
Fortunatti, Cecilia
|
|
2017
|
136 |
C |
p. 280-296
|
artikel
|
| 27 |
Molecular dynamics simulations of water flow enhancement in carbon nanochannels
|
Li, Wen
|
|
2017
|
136 |
C |
p. 60-66
|
artikel
|
| 28 |
Multi-phase-field simulation of cyclic phase transformation in Fe-C-Mn and Fe-C-Mn-Si alloys
|
Segawa, Masahito
|
|
2017
|
136 |
C |
p. 67-75
|
artikel
|
| 29 |
Phonon spectrum and thermodynamic properties of LaCoO3 based on first-principles theory
|
Wang, Xiao
|
|
2017
|
136 |
C |
p. 191-197
|
artikel
|
| 30 |
Potential application of multilayer n-type tungsten diselenide (WSe2) sheet as transparent conducting electrode in silicon heterojunction solar cell
|
Tiwari, Pranjala
|
|
2017
|
136 |
C |
p. 102-108
|
artikel
|
| 31 |
Structural properties and mechanical stability of lithium-ion based materials. A theoretical study
|
Zulueta, Yohandys A.
|
|
2017
|
136 |
C |
p. 271-279
|
artikel
|
| 32 |
Synergistic effect of nitrogen and sulfur co-doped graphene as efficient metal-free counter electrode for dye-sensitized solar cells: A first-principle study
|
Liu, Yang
|
|
2017
|
136 |
C |
p. 44-51
|
artikel
|
| 33 |
The distribution of excess carriers and their effects on water dissociation on rutile (110) surface
|
Wen, Bo
|
|
2017
|
136 |
C |
p. 150-156
|
artikel
|
| 34 |
The magnetoresistance effect and spin-polarized photocurrent of zigzag graphene-graphyne nanoribbon heterojunctions
|
Li, Ying
|
|
2017
|
136 |
C |
p. 1-11
|
artikel
|
| 35 |
Theoretical study of electronic transport properties of lead nanowires doped with silicon
|
Zhang, Lishu
|
|
2017
|
136 |
C |
p. 198-206
|
artikel
|
| 36 |
Works of separation for (0001)ZnO|(111)ZrO2 interfaces: A first-principle study
|
Sun, Wenming
|
|
2017
|
136 |
C |
p. 157-162
|
artikel
|
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