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                             54 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 AFLOW-ML: A RESTful API for machine-learning predictions of materials properties Gossett, Eric
 2018
 152 C p. 134-145
 artikel
2 A modified CALPHAD model for thermal expansion coefficient in Invar Ni-Fe(FCC) alloys Ding, Qi
 2018
 152 C p. 178-182
 artikel
3 An accurate computational method for analysis of electromechanical properties of structures with metal-GaN piezoelectric semiconductor contact Qin, Guoshuai
 2018
 152 C p. 70-77
 artikel
4 Atomistic simulation of shape memory effect (SME) and superelasticity (SE) in nano-porous NiTi shape memory alloy (SMA) Gur, Sourav
 2018
 152 C p. 28-37
 artikel
5 Atomistic simulation study of the hydrogen diffusion in nickel Torres, E.
 2018
 152 C p. 374-380
 artikel
6 Atomistic study of the bending properties of silicon nanowires Zhuo, X.R.
 2018
 152 C p. 331-336
 artikel
7 Atomistic study on the super-elasticity of nanocrystalline NiTi shape memory alloy subjected to a cyclic deformation Wang, Bing
 2018
 152 C p. 85-92
 artikel
8 Bandgap engineering of Janus MoSSe monolayer implemented by Se vacancy Wen, Yan-Ni
 2018
 152 C p. 20-27
 artikel
9 Bridging molecular dynamics and phase-field methods for grain growth prediction Miyoshi, Eisuke
 2018
 152 C p. 118-124
 artikel
10 Cohesive laws for shearing of iron/precipitate interfaces Elzas, A.
 2018
 152 C p. 417-429
 artikel
11 Competition between two Fleischer modes of cross slip in silver Li, K.Q.
 2018
 152 C p. 93-98
 artikel
12 Computational modeling of the photovoltaic activities in EABX3 (EA = ethylammonium, B = Pb, Sn, Ge, X = Cl, Br, I) perovskite solar cells Arkan, Foroogh
 2018
 152 C p. 324-330
 artikel
13 Critical role of tetrasilanolphenyl–POSS moieties in competing mechanism of rigid cages and soft segments and its effect on the glass transition temperature of epoxy hybrids Pan, Rui
 2018
 152 C p. 78-84
 artikel
14 Designing nanoindentation simulation studies by appropriate indenter choices: Case study on single crystal tungsten Goel, Saurav
 2018
 152 C p. 196-210
 artikel
15 Diffusion kinetics of transient liquid phase bonding of Ni-based superalloy with Ni nanoparticles: A molecular dynamics perspective Wang, Jiaqi
 2018
 152 C p. 228-235
 artikel
16 Editorial Board 2018
 152 C p. ii
 artikel
17 Effect of solutes on the lattice parameters and elastic stiffness coefficients of body-centered tetragonal Fe Fellinger, Michael R.
 2018
 152 C p. 308-323
 artikel
18 Enhanced hydrogen sorption kinetics of co-doped MgH2 hydrides El Khatabi, M.
 2018
 152 C p. 192-195
 artikel
19 Evaluation of the structure and properties for the high-temperature phase of zirconium from the atomistic simulations Smirnova, D.E.
 2018
 152 C p. 51-59
 artikel
20 Evolution of nanostructure and mechanical properties of silver nano-particle in the confined region between graphene sheets: An atomistic investigation Kumar, Sunil
 2018
 152 C p. 393-407
 artikel
21 Exotic high-pressure behavior of double nitride CuPN2 Xu, Dan
 2018
 152 C p. 217-222
 artikel
22 Failure mechanisms in pre-cracked Ni-graphene nanocomposites Muller, Scott E.
 2018
 152 C p. 341-350
 artikel
23 Fast predictive models based on multi-fidelity sampling of properties in molecular dynamics simulations Razi, M.
 2018
 152 C p. 125-133
 artikel
24 First principles study of electronic and optical properties of Ag 2 CdSnS 4 chalcogenides for photovoltaic applications Saidi, S.
 2018
 152 C p. 291-299
 artikel
25 First principles study of phase stability and ferroelectric properties of Bi1−xRExFeO3 (RE = Y, La) solid solutions Kaczkowski, J.
 2018
 152 C p. 183-191
 artikel
26 Gas permeability of Ti6Al4V foams prepared via gelcasting, experiments and modelling Lux, Jérôme
 2018
 152 C p. 363-373
 artikel
27 Impact of correlative defects induced by double Re-addition on the ideal shear strength of γ′-Ni3Al phases Chen, Yi
 2018
 152 C p. 408-416
 artikel
28 Influence of loading directions on dislocation slip mechanism of nanotwinned Ni with void defect at the twin boundary Ding, Jun
 2018
 152 C p. 1-11
 artikel
29 Lattice-matched heterojunctions between blue phosphorene and MXene Y2CX2 (X = F, O, and Y = Zr, Hf) Li, Geng
 2018
 152 C p. 256-261
 artikel
30 Matminer: An open source toolkit for materials data mining Ward, Logan
 2018
 152 C p. 60-69
 artikel
31 MD-based characterization of plastic deformation in Cu/Ag nanocomposites via dislocation extraction analysis: Effects of nanosized surface porosities and voids Kardani, A.
 2018
 152 C p. 381-392
 artikel
32 Mechanical behavior of Cu-W interface systems upon tensile loading from molecular dynamics simulations Ma, G.C.
 2018
 152 C p. 165-168
 artikel
33 Molecular dynamics simulation of the interface between sulfur mustard and graphene Ebrahimi, Leila
 2018
 152 C p. 355-360
 artikel
34 Molecular dynamics simulation on the physical properties of the novel designed poly-(phthalazinone ether sulfone ketone) (PPESK) Shu, Yao
 2018
 152 C p. 158-164
 artikel
35 Molecular dynamics simulations of displacement cascades in nanotwinned Cu Li, Bo
 2018
 152 C p. 38-42
 artikel
36 Molecular modeling of low bandgap diblock co-oligomers with π -bridges for applications in photovoltaics Alves, Gabriel G.B.
 2018
 152 C p. 12-19
 artikel
37 Non-linear behavior of germanium electronic band structure under high strain Escalante, Jose M.
 2018
 152 C p. 223-227
 artikel
38 Parameter covariance and non-uniqueness in material model calibration using the Virtual Fields Method Jones, E.M.C.
 2018
 152 C p. 268-290
 artikel
39 Point defect effects on the thermal conductivity of β -SiC by molecular dynamics simulations Mao, Yichen
 2018
 152 C p. 300-307
 artikel
40 Quasiparticle bands and optical properties of SnSe from an ab initio approach Meléndez, Juan J.
 2018
 152 C p. 107-112
 artikel
41 Revealing the local lattice strains and strengthening mechanisms of Ti alloys Zou, Chengxiong
 2018
 152 C p. 169-177
 artikel
42 Strengthening mechanism of gradient nanostructured body-centred cubic iron film: From inverse Hall-Petch to classic Hall-Petch Fang, Qihong
 2018
 152 C p. 236-242
 artikel
43 Structures and electronic properties of halogenated Au(III) phthalocyanine AuPcX (X = Cl, Br): A Density Functional Theoretical Study Dai, Guoliang
 2018
 152 C p. 262-267
 artikel
44 Tailoring the stability of { 1 0 1 ¯ 2 } twins in magnesium with solute segregation at the twin boundary and strain path control Zhu, Heyu
 2018
 152 C p. 113-117
 artikel
45 The binding of calcium ion with different groups of superplasticizers studied by three DFT methods, B3LYP, M06-2X and M06 Zhao, Hongxia
 2018
 152 C p. 43-50
 artikel
46 The multi-scale grand challenge of radiation damage modeling Capolungo, Laurent
 2018
 152 C p. 361-362
 artikel
47 Theoretical study of the adsorption of SF6 decomposition components on Ni(1 1 1) surface Li, Jie
 2018
 152 C p. 248-255
 artikel
48 Theoretical study of the R3c-to-Pnma phase transition in BiAlO3 Li, Qiang
 2018
 152 C p. 211-216
 artikel
49 The prediction of upper limit of copper content in CoBCu glass-forming alloys Dong, B.S.
 2018
 152 C p. 351-354
 artikel
50 Thermoelectric properties of SnSe (Pnma) under hydrostatic pressure Gusmão, M.S.
 2018
 152 C p. 243-247
 artikel
51 Two-dimensional Janus transition-metal dichalcogenides with intrinsic ferromagnetism and half-metallicity He, Junjie
 2018
 152 C p. 151-157
 artikel
52 Van der Waals interactions and the properties of graphite and 2H-, 3R- and 1T-MoS2: A comparative study Novais Antunes, Florence P.
 2018
 152 C p. 146-150
 artikel
53 Vibrational and thermoelastic properties of bcc iron from selected EAM potentials Dragoni, Daniele
 2018
 152 C p. 99-106
 artikel
54 What is the maximum electrochemical Li insertion capacity in anatase? Insights from Density Functional Theory Barone, Veronica
 2018
 152 C p. 337-340
 artikel
                             54 gevonden resultaten
 
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