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                             36 results found
no title author magazine year volume issue page(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
article
2 An effective constitutive model for polycrystalline ferroelectric ceramics: Theoretical framework and numerical examples Tan, Wei Lin
2017
136 C p. 223-237
article
3 A numerical model coupling diffusion and grain growth in nanocrystalline materials Zhao, Jingyi
2017
136 C p. 243-252
article
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
article
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
article
6 Continuum modeling of surface roughening in heteroepitaxial structures based on phase field theory Wang, Liyuan
2017
136 C p. 109-117
article
7 Crack detection in lithium-ion cells using machine learning Petrich, Lukas
2017
136 C p. 297-305
article
8 Data mining assisted materials design of layered double hydroxide with desired specific surface area Hu, Biao
2017
136 C p. 29-35
article
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
article
10 DFT study of the interactions of H2O, O2 and H2O+O2 with TiO2 (101) surface Du, Zheng
2017
136 C p. 173-180
article
11 Effects of terminated atoms, porosity and drilling orientations on the band structure of porous silicon Zhang, Kaiqi
2017
136 C p. 126-132
article
12 First-principle study of graphyne-like BN sheet: Electronic structure and optical properties Zhang, Yanni
2017
136 C p. 12-19
article
13 First principle study of V-implantation in highly-doped silicon materials García, Gregorio
2017
136 C p. 207-215
article
14 Frictional properties of multi-asperity surfaces at the nanoscale Santhapuram, Raghuram R.
2017
136 C p. 253-263
article
15 Generating derivative superstructures for systems with high configurational freedom Morgan, Wiley S.
2017
136 C p. 144-149
article
16 Generation of 3D polycrystalline microstructures with a conditioned Laguerre-Voronoi tessellation technique Falco, Simone
2017
136 C p. 20-28
article
17 GPU-accelerated three-dimensional phase-field simulation of dendrite growth in a nickel-based superalloy Yang, Cong
2017
136 C p. 133-143
article
18 IFC 2017
136 C p. IFC
article
19 Investigation on mechanical properties of polycrystalline W nanowire Saha, Sourav
2017
136 C p. 52-59
article
20 Mechanical properties of penta-graphene, hydrogenated penta-graphene, and penta-CN2 sheets Le, Minh-Quy
2017
136 C p. 181-190
article
21 Mechanical stability and superconductivity of PbO-type phase of thorium monocarbide at high pressure Yan, Yan
2017
136 C p. 238-242
article
22 Mechanistic study of bending creep behaviour of bicrystal nanobeam Vijay Reddy, K.
2017
136 C p. 36-43
article
23 Mixed-mode fracture toughness evaluation of a copper single crystal using atomistic simulations Cui, Cheng Bin
2017
136 C p. 216-222
article
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
article
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
article
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
article
27 Molecular dynamics simulations of water flow enhancement in carbon nanochannels Li, Wen
2017
136 C p. 60-66
article
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
article
29 Phonon spectrum and thermodynamic properties of LaCoO3 based on first-principles theory Wang, Xiao
2017
136 C p. 191-197
article
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
article
31 Structural properties and mechanical stability of lithium-ion based materials. A theoretical study Zulueta, Yohandys A.
2017
136 C p. 271-279
article
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
article
33 The distribution of excess carriers and their effects on water dissociation on rutile (110) surface Wen, Bo
2017
136 C p. 150-156
article
34 The magnetoresistance effect and spin-polarized photocurrent of zigzag graphene-graphyne nanoribbon heterojunctions Li, Ying
2017
136 C p. 1-11
article
35 Theoretical study of electronic transport properties of lead nanowires doped with silicon Zhang, Lishu
2017
136 C p. 198-206
article
36 Works of separation for (0001)ZnO|(111)ZrO2 interfaces: A first-principle study Sun, Wenming
2017
136 C p. 157-162
article
                             36 results found
 
 Koninklijke Bibliotheek - National Library of the Netherlands