nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Ab initio-based prediction and TEM study of silicide precipitation in titanium
|
Poletaev, D.O. |
|
2014 |
95 |
C |
p. 456-463 8 p. |
artikel |
2 |
Ab initio calculations of the structural, elastic, electronic and optical properties of Cu3N as well as Cu3NLa and Cu3NCe compounds
|
Wu, Zhenli |
|
2014 |
95 |
C |
p. 221-227 7 p. |
artikel |
3 |
Ab-initio determination of thermodynamic properties of CoSi2
|
Niranjan, Manish K. |
|
2014 |
95 |
C |
p. 517-521 5 p. |
artikel |
4 |
Accurate projected augmented wave (PAW) datasets for rare-earth elements (RE=La–Lu)
|
Topsakal, M. |
|
2014 |
95 |
C |
p. 263-270 8 p. |
artikel |
5 |
A density functional theory (DFT) study of CO2 adsorption on Mg-rich minerals by enhanced charge distribution
|
Kwon, Soonchul |
|
2014 |
95 |
C |
p. 181-186 6 p. |
artikel |
6 |
A generalized plane-wave formulation of k · p formalism and continuum-elasticity approach to elastic and electronic properties of semiconductor nanostructures
|
Marquardt, Oliver |
|
2014 |
95 |
C |
p. 280-287 8 p. |
artikel |
7 |
A mean-field interatomic potential for a multi-component β-type titanium alloy
|
Liu, Yanxia |
|
2014 |
95 |
C |
p. 414-419 6 p. |
artikel |
8 |
Amorphization anisotropy and the internal of amorphous layer in diamond nanoscale friction
|
Yang, Ning |
|
2014 |
95 |
C |
p. 551-556 6 p. |
artikel |
9 |
A multi-scale computational method including contact for the analysis of damage in composite materials
|
Drosopoulos, Georgios A. |
|
2014 |
95 |
C |
p. 522-535 14 p. |
artikel |
10 |
Analyzing molecular dynamics scattered data for large atomic movements
|
Shakya, Shobhit S. |
|
2014 |
95 |
C |
p. 198-206 9 p. |
artikel |
11 |
An effective inverse procedure for identifying viscoplastic material properties of polymer Nafion
|
Zhang, Wei |
|
2014 |
95 |
C |
p. 159-165 7 p. |
artikel |
12 |
An efficient method to generate amorphous structures based on local geometry
|
Youn, Yong |
|
2014 |
95 |
C |
p. 256-262 7 p. |
artikel |
13 |
A new approach to the determination of plastic flow stress and failure initiation strain for aluminum alloys cutting process
|
Chen, Guang |
|
2014 |
95 |
C |
p. 568-578 11 p. |
artikel |
14 |
An inverse analysis approach based on a POD direct model for the mechanical characterization of metallic materials
|
Bocciarelli, M. |
|
2014 |
95 |
C |
p. 302-308 7 p. |
artikel |
15 |
A phase-field model of twinning and detwinning coupled with dislocation-based crystal plasticity for HCP metals
|
Kondo, R. |
|
2014 |
95 |
C |
p. 672-683 12 p. |
artikel |
16 |
A practical flow diagram for the solution of complex non-linear thermo-mechanical numerical models
|
Karalis, D.G. |
|
2014 |
95 |
C |
p. 288-301 14 p. |
artikel |
17 |
Assessment of irradiation hardening by DD simulations
|
Durgaprasad, P.V. |
|
2014 |
95 |
C |
p. 393-398 6 p. |
artikel |
18 |
Crystallization of supercooled liquid and glassy Fe thin films
|
Hoang, Vo Van |
|
2014 |
95 |
C |
p. 491-501 11 p. |
artikel |
19 |
Dendritic growth of high carbon iron-based alloy under constrained melt flow
|
Wang, Weiling |
|
2014 |
95 |
C |
p. 136-148 13 p. |
artikel |
20 |
Development a dislocation density based model considering the effect of stacking fault energy: Severe plastic deformation
|
Parvin, H. |
|
2014 |
95 |
C |
p. 250-255 6 p. |
artikel |
21 |
Development of a ReaxFF reactive force field for intrinsic point defects in titanium dioxide
|
Huygh, Stijn |
|
2014 |
95 |
C |
p. 579-591 13 p. |
artikel |
22 |
Dimension reduction of defect properties for application in 2D dislocation dynamics
|
Topuz, Ahmet Ilker |
|
2014 |
95 |
C |
p. 13-20 8 p. |
artikel |
23 |
Doping-dependent thermoelectric properties of BiSb3Te6 from first-principle calculations
|
Feng, Songke |
|
2014 |
95 |
C |
p. 563-567 5 p. |
artikel |
24 |
Dynamical and dielectric properties of MP2O7 (M=Ti, Zr, and Hf): A first-principles investigation
|
Xiang, Huimin |
|
2014 |
95 |
C |
p. 371-376 6 p. |
artikel |
25 |
Effect of boundary conditions on the MD simulation of nanoindentation
|
Yaghoobi, Mohammadreza |
|
2014 |
95 |
C |
p. 626-636 11 p. |
artikel |
26 |
Effect of CNT waviness on the effective mechanical properties of long and short CNT reinforced composites
|
Paunikar, Shweta |
|
2014 |
95 |
C |
p. 21-28 8 p. |
artikel |
27 |
Effect of electric field and Sn grain orientation on Cu consumption in Sn/Cu solder joint
|
Chen, Jie-Shi |
|
2014 |
95 |
C |
p. 166-171 6 p. |
artikel |
28 |
Effects of hollow particle shape and distribution on the elastic properties of syntactic foams: 3D computational modeling
|
Nian, Guodong |
|
2014 |
95 |
C |
p. 106-112 7 p. |
artikel |
29 |
Effects of twist twin boundary and stacking fault on crack propagation of nanocrystal Al
|
Gao, L. |
|
2014 |
95 |
C |
p. 484-490 7 p. |
artikel |
30 |
Elastic constants of cubic crystals
|
Jamal, M. |
|
2014 |
95 |
C |
p. 592-599 8 p. |
artikel |
31 |
Elastic moduli of covalently functionalized single layer graphene sheets
|
Shah, P.H. |
|
2014 |
95 |
C |
p. 637-650 14 p. |
artikel |
32 |
Electronic and magnetic properties of transition-metal-doped sodium superatom clusters: TM@Na8 (TM=3d, 4d and 5d transition metal)
|
Guo, Ping |
|
2014 |
95 |
C |
p. 440-445 6 p. |
artikel |
33 |
Electronic structure and optical properties of lithium tetraborate detector calculated using semi-local exchange correlation potential
|
Santos, C. |
|
2014 |
95 |
C |
p. 271-275 5 p. |
artikel |
34 |
Electronic structures and optical properties of SnSe2(1− x )O2 x alloys
|
Xia, Congxin |
|
2014 |
95 |
C |
p. 712-717 6 p. |
artikel |
35 |
Electronic transport properties of graphene nanoribbon heterojunctions with 5–7–5 ring defect
|
Wu, Guo-xun |
|
2014 |
95 |
C |
p. 84-88 5 p. |
artikel |
36 |
Evolution of geometrical structures, stabilities and electronic properties of neutral and anionic Nb n −1Co (n =2–9) clusters: Comparison with pure niobium clusters
|
Li, Hong-Hong |
|
2014 |
95 |
C |
p. 600-609 10 p. |
artikel |
37 |
Experimental observation and numerical simulation of SiC3D/Al interpenetrating phase composite material subjected to a three-point bending load
|
Wang, Linlin |
|
2014 |
95 |
C |
p. 408-413 6 p. |
artikel |
38 |
Failure and toughness of bio-inspired composites: Insights from phase field modelling
|
Khaderi, S.N. |
|
2014 |
95 |
C |
p. 1-7 7 p. |
artikel |
39 |
Finite element analysis of the grain size effect on diffusion in polycrystalline materials
|
Lacaille, V. |
|
2014 |
95 |
C |
p. 187-191 5 p. |
artikel |
40 |
Finite element modelling of tensile deformation and failure of aluminium plate exposed to fire
|
Afaghi Khatibi, A. |
|
2014 |
95 |
C |
p. 242-249 8 p. |
artikel |
41 |
First-principles investigation of elastic and thermodynamic properties of SiCN under pressure
|
Jia, Jinhuan |
|
2014 |
95 |
C |
p. 228-234 7 p. |
artikel |
42 |
First-principles investigation of the electronic structure and magnetic properties of multiferroic PrMn2O5
|
Zhang, J. |
|
2014 |
95 |
C |
p. 470-475 6 p. |
artikel |
43 |
First-principles prediction of the structural and electronic properties of Ga x Y1 − x N compounds
|
Cherchab, Youcef |
|
2014 |
95 |
C |
p. 509-516 8 p. |
artikel |
44 |
First-principles studies of the structural, electronic and optical properties of dinitrides CN2, SiN2 and GeN2
|
Manyali, George S. |
|
2014 |
95 |
C |
p. 706-711 6 p. |
artikel |
45 |
First-principles study of structural stability, elastic and dynamical properties of MnS
|
Kavcı, Onur |
|
2014 |
95 |
C |
p. 99-105 7 p. |
artikel |
46 |
Geometries, stabilities, and electronic properties of small Ga n Ti(0,±1) (n =1–10) clusters studied by density functional theory
|
Shi, Shunping |
|
2014 |
95 |
C |
p. 476-483 8 p. |
artikel |
47 |
Glass formation and icosahedral medium-range order in liquid Ti–Al alloys
|
Xie, Zhuo-Cheng |
|
2014 |
95 |
C |
p. 502-508 7 p. |
artikel |
48 |
Graphene reinforced nanocomposites: 3D simulation of damage and fracture
|
Dai, Gaoming |
|
2014 |
95 |
C |
p. 684-692 9 p. |
artikel |
49 |
Identification of the mechanical properties of the carbon fiber and the interphase region based on computational micromechanics and Kriging metamodel
|
Lu, Jiahai |
|
2014 |
95 |
C |
p. 172-180 9 p. |
artikel |
50 |
IFC
|
|
|
2014 |
95 |
C |
p. IFC- 1 p. |
artikel |
51 |
Material-based design of the extrusion of bimetallic tubes
|
Knezevic, Marko |
|
2014 |
95 |
C |
p. 63-73 11 p. |
artikel |
52 |
Materials properties of magnesium and calcium hydroxides from first-principles calculations
|
Pishtshev, A. |
|
2014 |
95 |
C |
p. 693-705 13 p. |
artikel |
53 |
Mechanism of hydrogen production via water splitting on 3C-SiC’s different surfaces: A first-principles study
|
Du, Jinglian |
|
2014 |
95 |
C |
p. 451-455 5 p. |
artikel |
54 |
Microstructure- and surface orientation-dependent mechanical behaviors of Ag nanowires under bending
|
Zhang, S.B. |
|
2014 |
95 |
C |
p. 53-62 10 p. |
artikel |
55 |
Modeling ablative behavior and thermal response of carbon/carbon composites
|
Yin, Tiantian |
|
2014 |
95 |
C |
p. 35-40 6 p. |
artikel |
56 |
Modeling of lattice structure and dynamics of Ge doped α-quartz
|
Kislov, A.N. |
|
2014 |
95 |
C |
p. 276-279 4 p. |
artikel |
57 |
Modeling of molar volume of the sigma phase involving transition elements
|
Liu, Wei |
|
2014 |
95 |
C |
p. 540-550 11 p. |
artikel |
58 |
Modeling of morphological evolution of columnar dendritic grains in the molten pool of gas tungsten arc welding
|
Han, Rihong |
|
2014 |
95 |
C |
p. 351-361 11 p. |
artikel |
59 |
Molecular dynamics simulation of wetting and interfacial behaviors of argon fluid confined in smooth and groove-patterned rough nano-channels
|
Li, Qun |
|
2014 |
95 |
C |
p. 121-128 8 p. |
artikel |
60 |
Molecular dynamics simulation on the effect of the distance between SWCNTs for short polymers diffusion among single wall carbon nanotubes
|
Zhao, Xin-ting |
|
2014 |
95 |
C |
p. 446-450 5 p. |
artikel |
61 |
Molecular dynamics study of the micro-spallation of single crystal tin
|
Liao, Yi |
|
2014 |
95 |
C |
p. 89-98 10 p. |
artikel |
62 |
Multi-physics simulation of oxygen diffusion in PSZ–Ti composites during spark plasma sintering process
|
Fukui, Yamato |
|
2014 |
95 |
C |
p. 29-34 6 p. |
artikel |
63 |
Multi-scale modeling of dislocation boundaries: Understanding interaction and effect of rotation angle
|
Khan, Shafique M.A. |
|
2014 |
95 |
C |
p. 435-439 5 p. |
artikel |
64 |
Numerical analysis of elastic–plastic properties of polymer composite reinforced by wavy and random CNTs
|
Yuan, Zeshuai |
|
2014 |
95 |
C |
p. 610-619 10 p. |
artikel |
65 |
Numerical modeling of dual phase microstructure behavior under deformation conditions on the basis of digital material representation
|
Madej, L. |
|
2014 |
95 |
C |
p. 651-662 12 p. |
artikel |
66 |
Numerical simulations and modeling of the stability of noble gas atoms in interaction with vacancies in silicon
|
Pizzagalli, L. |
|
2014 |
95 |
C |
p. 149-158 10 p. |
artikel |
67 |
Optimized Lattice Monte Carlo for thermal analysis of composites
|
Fiedler, T. |
|
2014 |
95 |
C |
p. 207-212 6 p. |
artikel |
68 |
Optoelectronic and transport properties of Zintl phase KBa2Cd2Sb3 compound
|
Khan, Saleem Ayaz |
|
2014 |
95 |
C |
p. 328-336 9 p. |
artikel |
69 |
Peptide–zinc oxide interaction: Finite element simulation using cohesive zone models based on molecular dynamics simulation
|
Schäfer, I. |
|
2014 |
95 |
C |
p. 320-327 8 p. |
artikel |
70 |
Perspectives for cellular automata for the simulation of dendritic solidification – A review
|
Reuther, K. |
|
2014 |
95 |
C |
p. 213-220 8 p. |
artikel |
71 |
Phase field modeling of ideal grain growth in a distorted microstructure
|
Jamshidian, M. |
|
2014 |
95 |
C |
p. 663-671 9 p. |
artikel |
72 |
Phase stability and mechanical properties of ruthenium borides from first principles calculations
|
Zhang, Xiaozheng |
|
2014 |
95 |
C |
p. 377-383 7 p. |
artikel |
73 |
Phonon instability and ideal strength of silicene under tension
|
Yang, Chuanghua |
|
2014 |
95 |
C |
p. 420-428 9 p. |
artikel |
74 |
Piezoelectric molecular dynamics model for boron nitride nanotubes
|
Yamakov, Vesselin |
|
2014 |
95 |
C |
p. 362-370 9 p. |
artikel |
75 |
Preserving the half-metallicity at the interfaces of zinc-blende MnSb/GaSb heterojunction: A density functional theory study
|
Liu, N. |
|
2014 |
95 |
C |
p. 557-562 6 p. |
artikel |
76 |
Pseudopotentials periodic table: From H to Pu
|
Dal Corso, Andrea |
|
2014 |
95 |
C |
p. 337-350 14 p. |
artikel |
77 |
Spintronic and electronic properties of a positively charged NBVN center in hexagonal boron nitride monolayer
|
Zhang, Y.G. |
|
2014 |
95 |
C |
p. 316-319 4 p. |
artikel |
78 |
Strain-induced variation of electronic structure of helium in tungsten and its effects on dissolution and diffusion
|
Li, Yu-Hao |
|
2014 |
95 |
C |
p. 536-539 4 p. |
artikel |
79 |
Structural evolution of nanoparticles under picosecond stress wave consolidation
|
Li, Chong |
|
2014 |
95 |
C |
p. 74-83 10 p. |
artikel |
80 |
Structure and bonding features of Ae6Mg7H26 (Ae=Sr, Ba) with complex polyhedrons: First-principles calculations
|
Zhou, Si-Chen |
|
2014 |
95 |
C |
p. 235-241 7 p. |
artikel |
81 |
The effects of adhesive strength and load on material transfer in nanoscale wear
|
Hu, Xiaoli |
|
2014 |
95 |
C |
p. 464-469 6 p. |
artikel |
82 |
The γ-Fe[N] and γ′-Fe4N1− x phase boundaries in high-nitrogen steels: The cube cluster approximation and the effect of vibrational energy contributions
|
Böttger, A.J. |
|
2014 |
95 |
C |
p. 8-12 5 p. |
artikel |
83 |
The lattice shift generated by two dimensional diffusion process
|
Wierzba, Bartek |
|
2014 |
95 |
C |
p. 192-197 6 p. |
artikel |
84 |
Theoretical exploration of the half-metallicity of graphene nanoribbons/boron nitride bilayer system
|
Wu, Hui |
|
2014 |
95 |
C |
p. 384-392 9 p. |
artikel |
85 |
Theoretical insights into the adsorption of monatomic Ag on the (2×2) BiOCl (001) surfaces
|
Zhang, Xiaochao |
|
2014 |
95 |
C |
p. 113-120 8 p. |
artikel |
86 |
Theoretical insights into the electronic and magnetic behaviors of the metal substituted 1H-MoS2 systems: Their potential towards CO adsorption and sensing
|
Basak, A. |
|
2014 |
95 |
C |
p. 399-407 9 p. |
artikel |
87 |
Theoretical studies on the plasticizing effect of DIANP on NC with various esterification degrees
|
Yang, Junqing |
|
2014 |
95 |
C |
p. 129-135 7 p. |
artikel |
88 |
Theoretical study on the elastic, electronic and thermodynamic properties of trigonal-type Cr2N under high pressures
|
Ma, Shiqing |
|
2014 |
95 |
C |
p. 620-625 6 p. |
artikel |
89 |
The study of the P doped silicene nanoribbons with first-principles
|
Zhang, Jian-Min |
|
2014 |
95 |
C |
p. 429-434 6 p. |
artikel |
90 |
Two-dimensional simulation of reactive diffusion in binary systems
|
Svoboda, J. |
|
2014 |
95 |
C |
p. 309-315 7 p. |
artikel |
91 |
Vibration mode localization in single- and multi-layered graphene nanoribbons
|
Verma, Deepti |
|
2014 |
95 |
C |
p. 41-52 12 p. |
artikel |