| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio phase diagram of WSe based on crystal structure prediction
|
Zhu, Cuan-Cuan
|
|
|
181 |
C |
p.
|
artikel
|
| 2 |
A hysteretic model for fiber-reinforced composites at finite strains: fractional derivatives, computational aspects and analysis
|
Denis, Yvan
|
|
|
181 |
C |
p.
|
artikel
|
| 3 |
A machine learning approach for increased throughput of density functional theory substitutional alloy studies
|
Yasin, Alhassan S.
|
|
|
181 |
C |
p.
|
artikel
|
| 4 |
Computing critical energy release rates for fracture in atomistic simulations
|
Xu, G.Q.
|
|
|
181 |
C |
p.
|
artikel
|
| 5 |
Crystallization of amorphous GeTe simulated by neural network potential addressing medium-range order
|
Lee, Dongheon
|
|
|
181 |
C |
p.
|
artikel
|
| 6 |
Data-driven stochastic optimization on manifolds for additive manufacturing
|
Marmarelis, Myrl G.
|
|
|
181 |
C |
p.
|
artikel
|
| 7 |
Editorial Board
|
|
|
|
181 |
C |
p.
|
artikel
|
| 8 |
Effects of cascade-induced dislocation structures on the long-term microstructural evolution in tungsten
|
Bonny, G.
|
|
|
181 |
C |
p.
|
artikel
|
| 9 |
Enhancing adhesion of Al2O3 scale on Ti-Al intermetallics by alloying: A first principles study
|
Li, Y.
|
|
|
181 |
C |
p.
|
artikel
|
| 10 |
First-principles study of chromium diffusion in the ferritic Fe-Cr alloy
|
Wang, Li-Peng
|
|
|
181 |
C |
p.
|
artikel
|
| 11 |
First-principles study of the tritium reaction and diffusion on the γ-LiAlO2 (1 0 0) surface with carbon impurity
|
Jia, Ting
|
|
|
181 |
C |
p.
|
artikel
|
| 12 |
Helium behaviors at Mn6Ni16Si7 precipitate in α-Fe: Insights from ab initio modeling
|
Jing, Yanmei
|
|
|
181 |
C |
p.
|
artikel
|
| 13 |
Hierarchical multi-scale models for mechanical response prediction of highly filled elastic–plastic and viscoplastic particulate composites
|
Li-Mayer, J.Y.S.
|
|
|
181 |
C |
p.
|
artikel
|
| 14 |
Microstructural classification of unirradiated LiAlO2 pellets by deep learning methods
|
Pazdernik, Karl
|
|
|
181 |
C |
p.
|
artikel
|
| 15 |
Migration behavior of tellurium in bcc iron against typical alloying elements: A first-principles study
|
Zhang, Zheng-De
|
|
|
181 |
C |
p.
|
artikel
|
| 16 |
Molecular simulation study on gas adsorption and separation performance of alkyl-functionalized HKUST materials
|
Zhou, Guanggang
|
|
|
181 |
C |
p.
|
artikel
|
| 17 |
Partitioning the vibrational spectrum: Fingerprinting defects in solids
|
Vanpoucke, Danny E.P.
|
|
|
181 |
C |
p.
|
artikel
|
| 18 |
Platinum doped alkali earth metal oxides as a qubit candidate
|
Zhou, Cuiqin
|
|
|
181 |
C |
p.
|
artikel
|
| 19 |
Probing a novel heat source model and adaptive remeshing technique to simulate laser powder bed fusion with experimental validation
|
Khan, Kajal
|
|
|
181 |
C |
p.
|
artikel
|
| 20 |
Strain-induced structural phase transition and the rotation of polarization in BaTiO3 films
|
Zhu, Senjie
|
|
|
181 |
C |
p.
|
artikel
|
| 21 |
Study on conductivity properties and stability of NbAs based on first-principles
|
Tang, Tian-yu
|
|
|
181 |
C |
p.
|
artikel
|
| 22 |
Towards band gap engineering via biaxial and axial strain in group IV crystals
|
Janik, Norbert
|
|
|
181 |
C |
p.
|
artikel
|
| 23 |
Two-dimensional FeC compound with square and triangle lattice structure – Molecular dynamics and DFT study
|
Hoang, Vo Van
|
|
|
181 |
C |
p.
|
artikel
|
| 24 |
What are the effects of cucurbit[n]uril on CTMS loading? Insights from QM calculations and MD simulations
|
Li, Lei
|
|
|
181 |
C |
p.
|
artikel
|
Tijdschrift beschrijving