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                             40 results found
no title author magazine year volume issue page(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.
article
2 A thermal fluctuation-based nucleation method for phase-field models Ode, Machiko

194 C p.
article
3 Atomistic modeling of meso-timescale processes with SEAKMC: A perspective and recent developments Hayakawa, Sho

194 C p.
article
4 Atomistic study and continuum modeling of solute strengthening in slip-CTB interaction Mao, Jianxing

194 C p.
article
5 Au5Br: A new member of highly stable 2D-type doped gold nanomaterial Zhu, Ben-Chao

194 C p.
article
6 Automated extraction of physical parameters from experimentally obtained thermal profiles using a machine learning approach Huang, Guanglong

194 C p.
article
7 Characterization of the strain rate effect under uniaxial loading for nanoporous gold Voyiadjis, George Z.

194 C p.
article
8 Crystal structure prediction in a continuous representative space Lee, In-Ho

194 C p.
article
9 Development of modified embedded-atom model and molecular dynamics simulation of cesium Lv, Weimiao

194 C p.
article
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.
article
11 Editorial Board
194 C p.
article
12 Effects of γ/γ lamellar interfaces on interlamellar crack propagation behaviors of TiAl alloys Fu, Rong

194 C p.
article
13 Elastic dipole tensors and relaxation volumes of point defects in concentrated random magnetic Fe-Cr alloys Wróbel, Jan S.

194 C p.
article
14 Electronic structures and optical properties of nanoporous complex oxide 12CaO · 7Al2O3 (C12A7) under high pressure Tangpakonsab, Parinya

194 C p.
article
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.
article
16 Fast three-dimensional rules-based simulation of thermal-sprayed microstructures Rodgers, Theron M.

194 C p.
article
17 First-principles calculations for attosecond electron dynamics in solids Sato, Shunsuke A.

194 C p.
article
18 First-principles study of high-pressure structural stability and mechanical properties of Ni2B Wang, Menglong

194 C p.
article
19 Formation energies of θ-Al2Cu phase and precursor Al-Cu compounds: Importance of on-site Coulomb repulsion Souissi, M.

194 C p.
article
20 Indentation and scratching of iron by a rotating tool – a molecular dynamics study Alabd Alhafez, Iyad

194 C p.
article
21 Insights into the tensile behavior of polymer nanofibers with hierarchically twisted chains Liu, Han

194 C p.
article
22 Intrinsic charge carrier mobility of 2D semiconductors Cheng, Long

194 C p.
article
23 Modeling brittle fracture due to anisotropic thermal expansion in polycrystalline materials Rezwan, Aashique A.

194 C p.
article
24 Multi-material model for the simulation of powder bed fusion additive manufacturing Küng, Vera E.

194 C p.
article
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.
article
26 Polaron transport in porous graphene nanoribbons da Cunha, Wiliam F.

194 C p.
article
27 Polymer informatics: Expert-in-the-loop in QSPR modeling of refractive index Schustik, Santiago A.

194 C p.
article
28 Reinforcement of polymer nanocomposites by ɑ-graphyne nanotubes: A multiscale simulation Najafi, Golnaz

194 C p.
article
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.
article
30 Simulating the electronic properties of semiconductor nanostructures using multiband k · p models Marquardt, Oliver

194 C p.
article
31 Space-time asymptotic expansion method for transient thermal conduction in the periodic composite with temperature-dependent thermal properties Zhai, Hongzhou

194 C p.
article
32 Stochastic modelling of 3D fiber structures imaged with X-ray microtomography Townsend, Philip

194 C p.
article
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.
article
34 Theoretically exploring covalent bonding effect on deformability of B2/β Ti(AlxNb1-x) phase Yang, Zhibiao

194 C p.
article
35 Theoretical study on defect properties of two-dimensional multilayer Ruddlesden-Popper lead iodine perovskite Song, Jiaxing

194 C p.
article
36 Thermodynamic stability of defects in hybrid MoS2/InAs heterostructures Santos, Zackary

194 C p.
article
37 Thickness- and strain-tunable electronic structures of two-dimensional Bi2O2Se Hu, Ce-Wen

194 C p.
article
38 Topologically nontrivial type-I and type-II nodal-line states in magnetic configurations of square-net pnictide CeCuBi2 Wang, Athena

194 C p.
article
39 Tuning nanoscale adhesive contact behavior to a near ideal Hertzian state via graphene coverage Chen, Yongchao

194 C p.
article
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.
article
                             40 results found
 
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