| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A simple method for computing the formation free energies of metal oxides
|
Chen, Hantong
|
|
|
198 |
C |
p.
|
artikel
|
| 2 |
Composition based crystal materials symmetry prediction using machine learning with enhanced descriptors
|
Li, Yuxin
|
|
|
198 |
C |
p.
|
artikel
|
| 3 |
Computational insight on molecular-network disproportionality in over-stoichiometric AsxS100−x nanoarsenicals (57 < x < 67)
|
Shpotyuk, Oleh
|
|
|
198 |
C |
p.
|
artikel
|
| 4 |
Corrigendum to “The thermochemistry library Thermochimica”
|
Bajpai, Parikshit
|
|
|
198 |
C |
p.
|
artikel
|
| 5 |
Deep learning approaches to semantic segmentation of fatigue cracking within cyclically loaded nickel superalloy
|
Menasche, David B.
|
|
|
198 |
C |
p.
|
artikel
|
| 6 |
Editorial Board
|
|
|
|
198 |
C |
p.
|
artikel
|
| 7 |
Effectively improving the accuracy of PBE functional in calculating the solid band gap via machine learning
|
Wan, Zhongyu
|
|
|
198 |
C |
p.
|
artikel
|
| 8 |
Effects of vertical strain and electric field on the electronic properties and interface contact of graphene/InP vdW heterostructure
|
Lu, Xuefeng
|
|
|
198 |
C |
p.
|
artikel
|
| 9 |
Electric field tunable bandgap and anisotropic high carrier mobility in SiAs2/GeAs2 lateral heterostructure
|
Feng, Leihao
|
|
|
198 |
C |
p.
|
artikel
|
| 10 |
Electrochemical etching of porous silicon – DFT modeling
|
Ptashchenko, Fedor
|
|
|
198 |
C |
p.
|
artikel
|
| 11 |
Electronic and optical excitation properties of vanadium pentoxide V2O5
|
Nguyen, Thi Dieu Hien
|
|
|
198 |
C |
p.
|
artikel
|
| 12 |
Electronic and optical properties of ultrathin cerium dioxide: A many-body GW-BSE investigation
|
Yang, Guang
|
|
|
198 |
C |
p.
|
artikel
|
| 13 |
Equivalent surface energy of nanovoids in metallic crystals
|
Sun, Yuyao
|
|
|
198 |
C |
p.
|
artikel
|
| 14 |
Exploring neural network training strategies to determine phase transitions in frustrated magnetic models
|
Corte, I.
|
|
|
198 |
C |
p.
|
artikel
|
| 15 |
Factors affecting the vacancy formation energy in Fe70Ni10Cr20 random concentrated alloy
|
Manzoor, Anus
|
|
|
198 |
C |
p.
|
artikel
|
| 16 |
Improved ductility by coupled motion of grain boundaries in nanocrystalline B2-FeCo alloys
|
Li, Y.L.
|
|
|
198 |
C |
p.
|
artikel
|
| 17 |
Improved physics-based structural descriptors of perovskite materials enable higher accuracy of machine learning
|
Li, Changjiao
|
|
|
198 |
C |
p.
|
artikel
|
| 18 |
Interaction between hydrogen and solute atoms in bcc iron
|
Sawada, H.
|
|
|
198 |
C |
p.
|
artikel
|
| 19 |
Kinetic Monte Carlo simulation framework for chemical short-range order formation kinetics in a multi-principal-element alloy
|
Shen, Zeqi
|
|
|
198 |
C |
p.
|
artikel
|
| 20 |
Lattice correspondence analysis on the formation mechanism for partial stacking faults in hexagonal close-packed metals
|
Li, B.
|
|
|
198 |
C |
p.
|
artikel
|
| 21 |
Machine learning elastic constants of multi-component alloys
|
Revi, Vivek
|
|
|
198 |
C |
p.
|
artikel
|
| 22 |
Mechanical and structural assessment of CuZr metallic glasses rejuvenated by thermal-pressure treatments
|
Amigo, Nicolás
|
|
|
198 |
C |
p.
|
artikel
|
| 23 |
Multi-material model for mesoscopic analysis of porosity evolution during laser powder-bed fusing TiNbTa powder mixture
|
Xia, Mujian
|
|
|
198 |
C |
p.
|
artikel
|
| 24 |
Neural-network model for force prediction in multi-principal-element alloys
|
Singh, R.
|
|
|
198 |
C |
p.
|
artikel
|
| 25 |
Optimization of the U parameter in CoO groupings in ZnO ( 10 1 ¯ 0 ) and ( 11 2 ¯ 0 ) surfaces: A DFT+U and UPS study
|
Stoltz, Kyle R.
|
|
|
198 |
C |
p.
|
artikel
|
| 26 |
Orthorhombic Fmmm-C80: A new superhard carbon allotrope with direct band gap
|
Tong, Wen
|
|
|
198 |
C |
p.
|
artikel
|
| 27 |
Prediction of the diffusion characteristics of the V-Cr system by molecular dynamics based on N-body interatomic potentials
|
Maksimenko, V.N.
|
|
|
198 |
C |
p.
|
artikel
|
| 28 |
Prediction of the Rb-Si compounds under high pressure
|
Cui, Xiangyue
|
|
|
198 |
C |
p.
|
artikel
|
| 29 |
Quantitative phase-field simulations of globulitic solidification from the critical nucleus with the effects of interface curvature and attachment kinetics
|
Maciel, R.R.
|
|
|
198 |
C |
p.
|
artikel
|
| 30 |
Selective oxidation of thermoelectric TiNiSn
|
Music, Denis
|
|
|
198 |
C |
p.
|
artikel
|
| 31 |
Signatures of the effects of defects on the bulk moduli of crystalline solids
|
Hoagland, Richard G.
|
|
|
198 |
C |
p.
|
artikel
|
| 32 |
Spatial and temporal heterogeneity of Kohlrausch–Williams–Watts stress relaxations in metallic glasses
|
Ishii, Akio
|
|
|
198 |
C |
p.
|
artikel
|
| 33 |
Suppressing effect of carbon on oxygen-induced embrittlement in molybdenum grain boundary
|
Wang, Zi-Qi
|
|
|
198 |
C |
p.
|
artikel
|
| 34 |
The effects of temperature and pressure on the physical properties and stabilities of point defects and defect complexes in B1-ZrC
|
Yang, Guanlin
|
|
|
198 |
C |
p.
|
artikel
|
| 35 |
Theoretical study on two dimensional group IV-VI ternary compounds with large in-plane spontaneous polarization
|
Fang, Hui
|
|
|
198 |
C |
p.
|
artikel
|
| 36 |
The precipitation competition of η-series precipitates and δ' precipitates in Li-containing Al-Zn-Mg-Cu alloys
|
Liu, Linghong
|
|
|
198 |
C |
p.
|
artikel
|
| 37 |
Thermal conductivity of magnesium selenide (MgSe)–A first principles study
|
Muthaiah, Rajmohan
|
|
|
198 |
C |
p.
|
artikel
|
| 38 |
Thermomechanical fatigue life due to scatter in constitutive parameters
|
Leidermark, Daniel
|
|
|
198 |
C |
p.
|
artikel
|
| 39 |
Topological aspects responsible for recrystallization evolution in an IF-steel sheet – Investigation with cellular-automaton simulations
|
Traka, Konstantina
|
|
|
198 |
C |
p.
|
artikel
|
| 40 |
Transverse mechanical properties of unidirectional FRP including resin-rich areas
|
Huang, Fangchao
|
|
|
198 |
C |
p.
|
artikel
|
| 41 |
Understanding the plasticity contributions during laser-shock loading and spall failure of Cu microstructures at the atomic scales
|
Echeverria, Marco J.
|
|
|
198 |
C |
p.
|
artikel
|
| 42 |
Vacancy effect on the structure and diffusion of a Li adatom on the 2D Janus MoSSe monolayer
|
Wen, Yan-ni
|
|
|
198 |
C |
p.
|
artikel
|
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