| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Activation free energies for formation and dissociation of N–N, C–C, and C–H bonds in a Na–Ga melt
|
Kawamura, Takahiro
|
|
|
194 |
C |
p.
|
artikel
|
| 2 |
A thermal fluctuation-based nucleation method for phase-field models
|
Ode, Machiko
|
|
|
194 |
C |
p.
|
artikel
|
| 3 |
Atomistic modeling of meso-timescale processes with SEAKMC: A perspective and recent developments
|
Hayakawa, Sho
|
|
|
194 |
C |
p.
|
artikel
|
| 4 |
Atomistic study and continuum modeling of solute strengthening in slip-CTB interaction
|
Mao, Jianxing
|
|
|
194 |
C |
p.
|
artikel
|
| 5 |
Au5Br: A new member of highly stable 2D-type doped gold nanomaterial
|
Zhu, Ben-Chao
|
|
|
194 |
C |
p.
|
artikel
|
| 6 |
Automated extraction of physical parameters from experimentally obtained thermal profiles using a machine learning approach
|
Huang, Guanglong
|
|
|
194 |
C |
p.
|
artikel
|
| 7 |
Characterization of the strain rate effect under uniaxial loading for nanoporous gold
|
Voyiadjis, George Z.
|
|
|
194 |
C |
p.
|
artikel
|
| 8 |
Crystal structure prediction in a continuous representative space
|
Lee, In-Ho
|
|
|
194 |
C |
p.
|
artikel
|
| 9 |
Development of modified embedded-atom model and molecular dynamics simulation of cesium
|
Lv, Weimiao
|
|
|
194 |
C |
p.
|
artikel
|
| 10 |
Domain-knowledge-oriented data pre-processing and machine learning of corrosion-resistant γ-U alloys with a small database
|
Yuan, Junhao
|
|
|
194 |
C |
p.
|
artikel
|
| 11 |
Editorial Board
|
|
|
|
194 |
C |
p.
|
artikel
|
| 12 |
Effects of γ/γ lamellar interfaces on interlamellar crack propagation behaviors of TiAl alloys
|
Fu, Rong
|
|
|
194 |
C |
p.
|
artikel
|
| 13 |
Elastic dipole tensors and relaxation volumes of point defects in concentrated random magnetic Fe-Cr alloys
|
Wróbel, Jan S.
|
|
|
194 |
C |
p.
|
artikel
|
| 14 |
Electronic structures and optical properties of nanoporous complex oxide 12CaO · 7Al2O3 (C12A7) under high pressure
|
Tangpakonsab, Parinya
|
|
|
194 |
C |
p.
|
artikel
|
| 15 |
Erratum to ‘The effects of introducing elasticity using different interpolation schemes to the grand potential phase field model’ [Comput. Mater. Sci. 183 (2020) 109790]
|
Simon, Pierre-Clément A.
|
|
|
194 |
C |
p.
|
artikel
|
| 16 |
Fast three-dimensional rules-based simulation of thermal-sprayed microstructures
|
Rodgers, Theron M.
|
|
|
194 |
C |
p.
|
artikel
|
| 17 |
First-principles calculations for attosecond electron dynamics in solids
|
Sato, Shunsuke A.
|
|
|
194 |
C |
p.
|
artikel
|
| 18 |
First-principles study of high-pressure structural stability and mechanical properties of Ni2B
|
Wang, Menglong
|
|
|
194 |
C |
p.
|
artikel
|
| 19 |
Formation energies of θ-Al2Cu phase and precursor Al-Cu compounds: Importance of on-site Coulomb repulsion
|
Souissi, M.
|
|
|
194 |
C |
p.
|
artikel
|
| 20 |
Indentation and scratching of iron by a rotating tool – a molecular dynamics study
|
Alabd Alhafez, Iyad
|
|
|
194 |
C |
p.
|
artikel
|
| 21 |
Insights into the tensile behavior of polymer nanofibers with hierarchically twisted chains
|
Liu, Han
|
|
|
194 |
C |
p.
|
artikel
|
| 22 |
Intrinsic charge carrier mobility of 2D semiconductors
|
Cheng, Long
|
|
|
194 |
C |
p.
|
artikel
|
| 23 |
Modeling brittle fracture due to anisotropic thermal expansion in polycrystalline materials
|
Rezwan, Aashique A.
|
|
|
194 |
C |
p.
|
artikel
|
| 24 |
Multi-material model for the simulation of powder bed fusion additive manufacturing
|
Küng, Vera E.
|
|
|
194 |
C |
p.
|
artikel
|
| 25 |
Nonlocal integral elasticity based phase field modelling and simulations of nanoscale thermal- and stress-induced martensitic transformations using a boundary effect compensation kernel
|
Danesh, Hooman
|
|
|
194 |
C |
p.
|
artikel
|
| 26 |
Polaron transport in porous graphene nanoribbons
|
da Cunha, Wiliam F.
|
|
|
194 |
C |
p.
|
artikel
|
| 27 |
Polymer informatics: Expert-in-the-loop in QSPR modeling of refractive index
|
Schustik, Santiago A.
|
|
|
194 |
C |
p.
|
artikel
|
| 28 |
Reinforcement of polymer nanocomposites by ɑ-graphyne nanotubes: A multiscale simulation
|
Najafi, Golnaz
|
|
|
194 |
C |
p.
|
artikel
|
| 29 |
Second nearest-neighbor modified embedded-atom method interatomic potentials for the Mo-M (M = Al, Co, Cr, Fe, Ni, Ti) binary alloy systems
|
Oh, Sang-Ho
|
|
|
194 |
C |
p.
|
artikel
|
| 30 |
Simulating the electronic properties of semiconductor nanostructures using multiband k · p models
|
Marquardt, Oliver
|
|
|
194 |
C |
p.
|
artikel
|
| 31 |
Space-time asymptotic expansion method for transient thermal conduction in the periodic composite with temperature-dependent thermal properties
|
Zhai, Hongzhou
|
|
|
194 |
C |
p.
|
artikel
|
| 32 |
Stochastic modelling of 3D fiber structures imaged with X-ray microtomography
|
Townsend, Philip
|
|
|
194 |
C |
p.
|
artikel
|
| 33 |
The nonlinear synergistic enhancement electric conductive effect in polymer-matrix composites containing hybrid fillers of carbon nanotubes and graphene nanoplatelets
|
Wu, Chen
|
|
|
194 |
C |
p.
|
artikel
|
| 34 |
Theoretically exploring covalent bonding effect on deformability of B2/β Ti(AlxNb1-x) phase
|
Yang, Zhibiao
|
|
|
194 |
C |
p.
|
artikel
|
| 35 |
Theoretical study on defect properties of two-dimensional multilayer Ruddlesden-Popper lead iodine perovskite
|
Song, Jiaxing
|
|
|
194 |
C |
p.
|
artikel
|
| 36 |
Thermodynamic stability of defects in hybrid MoS2/InAs heterostructures
|
Santos, Zackary
|
|
|
194 |
C |
p.
|
artikel
|
| 37 |
Thickness- and strain-tunable electronic structures of two-dimensional Bi2O2Se
|
Hu, Ce-Wen
|
|
|
194 |
C |
p.
|
artikel
|
| 38 |
Topologically nontrivial type-I and type-II nodal-line states in magnetic configurations of square-net pnictide CeCuBi2
|
Wang, Athena
|
|
|
194 |
C |
p.
|
artikel
|
| 39 |
Tuning nanoscale adhesive contact behavior to a near ideal Hertzian state via graphene coverage
|
Chen, Yongchao
|
|
|
194 |
C |
p.
|
artikel
|
| 40 |
Unraveling the formation mechanism of hydrogenated vacancy at γ-Ni/γ'-Ni3Al phase interface and its roles in interfacial stability and strength
|
Xue, Hong-Tao
|
|
|
194 |
C |
p.
|
artikel
|
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