| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio study of diffusion of hydrogen, silver and lithium in PbS and Ag2S
|
Oliveira, Ricardo R.
|
|
2019
|
166 |
C |
p. 75-81
|
artikel
|
| 2 |
Accurate representation of the distributions of the 3D Poisson-Voronoi typical cell geometrical features
|
Vittorietti, Martina
|
|
2019
|
166 |
C |
p. 111-118
|
artikel
|
| 3 |
A cellular automaton model integrated with CALPHAD-based thermodynamic calculations for ferrite-austenite phase transformations in multicomponent alloys
|
An, Dong
|
|
2019
|
166 |
C |
p. 210-220
|
artikel
|
| 4 |
A comparison of methods for the calculation of interface curvature in two-dimensional cellular automata solidification models
|
Reuther, Klemens
|
|
2019
|
166 |
C |
p. 143-149
|
artikel
|
| 5 |
An alternative approach to model mechanical stress effects on magnetic hysteresis in electrical steels using complex permeability
|
Baghel, A.P.S.
|
|
2019
|
166 |
C |
p. 96-104
|
artikel
|
| 6 |
An efficient strategy for large scale 3D simulation of heterogeneous materials to predict effective thermal conductivity
|
Liu, Xiaodong
|
|
2019
|
166 |
C |
p. 265-275
|
artikel
|
| 7 |
Application of materials informatics on crystalline materials for two-body terms approximation
|
Nguyen, Van-Doan
|
|
2019
|
166 |
C |
p. 155-161
|
artikel
|
| 8 |
Atomistic investigation of the effects of symmetric tilt grain boundary structures on irradiation response of the α-Fe containing carbon in solution
|
Zamzamian, Seyed Mehrdad
|
|
2019
|
166 |
C |
p. 82-95
|
artikel
|
| 9 |
Computational prediction and characterization of two-dimensional pentagonal arsenopyrite FeAsS
|
Liu, Lei
|
|
2019
|
166 |
C |
p. 105-110
|
artikel
|
| 10 |
Computer simulation of thermodynamic factors in Ni-Al and Cu-Ag liquid alloys
|
Belova, Irina V.
|
|
2019
|
166 |
C |
p. 124-135
|
artikel
|
| 11 |
Controlling the absorption strength in bidirectional terahertz metamaterial absorbers with patterned graphene
|
Van Huynh, Tran
|
|
2019
|
166 |
C |
p. 276-281
|
artikel
|
| 12 |
Coupling point defects and potential energy surface exploration
|
McGuigan, Brian C.
|
|
2019
|
166 |
C |
p. 1-8
|
artikel
|
| 13 |
Discontinuous model combined with an atomic mechanism simulates the precipitated η′ phase effect in intergranular cracking of 7-series aluminum alloys
|
Ji, Yucheng
|
|
2019
|
166 |
C |
p. 282-292
|
artikel
|
| 14 |
Editorial Board
|
|
|
2019
|
166 |
C |
p. ii
|
artikel
|
| 15 |
Effect of the Zener-Hollomon parameter on the dynamic recrystallization kinetics of Mg–Zn–Zr–Yb magnesium alloy
|
Li, Lu
|
|
2019
|
166 |
C |
p. 221-229
|
artikel
|
| 16 |
Electrolytic molecule in-pore structure and capacitance of supercapacitors with nanoporous carbon electrodes: A coarse-grained molecular dynamics study
|
Yang, Po-Yu
|
|
2019
|
166 |
C |
p. 293-302
|
artikel
|
| 17 |
Foreword to the Rising Stars virtual special issue of Computational Materials Science
|
Sinnott, Susan B.
|
|
2019
|
166 |
C |
p. 326
|
artikel
|
| 18 |
In-depth characterization of icosahedral ordering in liquid copper
|
Winczewski, Szymon
|
|
2019
|
166 |
C |
p. 57-74
|
artikel
|
| 19 |
Insights into the atomistic behavior in diamond chemical mechanical polishing with OH environment using ReaxFF molecular dynamics simulation
|
Shi, Zhuoying
|
|
2019
|
166 |
C |
p. 136-142
|
artikel
|
| 20 |
Introducing a method of constructing realistic closed cell nano-porous iron crystals and MD simulations to investigate the influence of the system size on the stability and the mechanical properties
|
Hummel, M.
|
|
2019
|
166 |
C |
p. 150-154
|
artikel
|
| 21 |
Li-doped and functionalized metal-organic framework-519 for enhancing hydrogen storage: A computational study
|
Xia, Liangzhi
|
|
2019
|
166 |
C |
p. 179-186
|
artikel
|
| 22 |
Machine learning for hierarchical prediction of elastic properties in Fe-Cr-Al system
|
Wang, Ruirui
|
|
2019
|
166 |
C |
p. 119-123
|
artikel
|
| 23 |
Methodology of an application of the steepest-entropy-ascent quantum thermodynamic framework to physical phenomena in materials science
|
Yamada, Ryo
|
|
2019
|
166 |
C |
p. 251-264
|
artikel
|
| 24 |
Molecular dynamics study of primary radiation damage in PuO2 and (U0.5Pu0.5)O2
|
Rahman, M.J.
|
|
2019
|
166 |
C |
p. 193-199
|
artikel
|
| 25 |
Novel high/ultrahigh pressure structures of TiO2 with low band gaps
|
Bedghiou, D.
|
|
2019
|
166 |
C |
p. 303-310
|
artikel
|
| 26 |
Pressure effects on local atomic structure of Ni15Co15Al70 metallic glasses
|
Kbirou, M.
|
|
2019
|
166 |
C |
p. 20-29
|
artikel
|
| 27 |
Rejuvenation saturation upon cyclic elastic loading in metallic glass
|
Li, Shuo
|
|
2019
|
166 |
C |
p. 318-325
|
artikel
|
| 28 |
Stochastic percolation model for the effect of nanotube agglomeration on the conductivity and piezoresistivity of hybrid nanocomposites
|
Gbaguidi, Audrey
|
|
2019
|
166 |
C |
p. 9-19
|
artikel
|
| 29 |
Synergistic approach to quantifying information on a crack-based network in loess/water material composites using deep learning and network science
|
Hwang, Heesu
|
|
2019
|
166 |
C |
p. 240-250
|
artikel
|
| 30 |
The effect of the particle surface and binder properties on the response of polymer bonded explosives at low impact velocities
|
Dandekar, Akshay
|
|
2019
|
166 |
C |
p. 170-178
|
artikel
|
| 31 |
Theoretical design of high-mobility bithiophene imide (BTI) derivative polymeric semiconductors
|
Sütay, Berkay
|
|
2019
|
166 |
C |
p. 162-169
|
artikel
|
| 32 |
Thermodynamic analysis and atomistic modeling of subsurface cavitation in photomechanical spallation
|
Shugaev, Maxim V.
|
|
2019
|
166 |
C |
p. 311-317
|
artikel
|
| 33 |
The smectic phase in semiflexible polymer materials: A large scale molecular dynamics study
|
Milchev, Andrey
|
|
2019
|
166 |
C |
p. 230-239
|
artikel
|
| 34 |
Topological transitions: A topological random walk or pure geometric necessity?
|
Zöllner, D.
|
|
2019
|
166 |
C |
p. 42-56
|
artikel
|
| 35 |
Towards better efficiency of interatomic linear machine learning potentials
|
Goryaeva, Alexandra M.
|
|
2019
|
166 |
C |
p. 200-209
|
artikel
|
| 36 |
Uncertainty and sensitivity analysis of mechanical and thermal properties computed through Embedded Atom Method potential
|
Dhaliwal, Gurjot
|
|
2019
|
166 |
C |
p. 30-41
|
artikel
|
| 37 |
Vacancy effect on the generalized stacking fault energy of alloyed γ-Ni system: A first-principles study
|
Hu, Peng
|
|
2019
|
166 |
C |
p. 187-192
|
artikel
|
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