| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Adsorption and reaction mechanism of UDMH and O2 on Cu2O (111) surface: A combined first-principles and reactive molecular dynamics study
|
Wang, Hao-yang
|
|
|
596 |
C |
p.
|
artikel
|
| 2 |
Analysis of the sensing performance of Ag-doped Ti3C2O2 MXene for characteristic gases in transformer oil
|
Teng, Zhengfu
|
|
|
596 |
C |
p.
|
artikel
|
| 3 |
Computational prediction of sublimation enthalpy of organic compounds using the Monte Carlo technique
|
Makari, Zahrah
|
|
|
596 |
C |
p.
|
artikel
|
| 4 |
Consideration on crystal growth, crystal structure, and molecular dynamics of [NH2(CH3)2]2ZnCl4 crystals
|
Lim, Ae Ran
|
|
|
596 |
C |
p.
|
artikel
|
| 5 |
Editorial Board
|
|
|
|
596 |
C |
p.
|
artikel
|
| 6 |
Effect of sulfur doping on the electronic structures, optical and photocatalytic properties of KTaO3 perovskites: DFT calculations
|
Ech-charqy, Z.
|
|
|
596 |
C |
p.
|
artikel
|
| 7 |
Exploiting charge transport for improving fill factor in flexible all-polymer solar cells
|
Li, Chunting
|
|
|
596 |
C |
p.
|
artikel
|
| 8 |
Extrusion of carbon with SON in heterocycles for enhanced static and dynamic hyperpolarizabilities and light harvesting efficiencies
|
Khan, Farah Tayyaba
|
|
|
596 |
C |
p.
|
artikel
|
| 9 |
First-principle quantum analysis of structural, electronic, optical, and mechanical properties of K3XH8 (X = Cr, Mn and Fe) hydrides for hydrogen storage system
|
Ahmed, Bilal
|
|
|
596 |
C |
p.
|
artikel
|
| 10 |
First-principles insights into metallic doping effects on yttrium twin grain boundary
|
Lyu, Guanlin
|
|
|
596 |
C |
p.
|
artikel
|
| 11 |
First-principles study of electronic, magnetic, optical, elastic, and thermoelectric properties of quaternary heusler alloys Co2MnSixGe1-x under dilution effect
|
El Krimi, Y.
|
|
|
596 |
C |
p.
|
artikel
|
| 12 |
Graphical abstract TOC
|
|
|
|
596 |
C |
p.
|
artikel
|
| 13 |
Graphical abstract TOC
|
|
|
|
596 |
C |
p.
|
artikel
|
| 14 |
Graphical abstract TOC
|
|
|
|
596 |
C |
p.
|
artikel
|
| 15 |
High-performance nitrogen-doped porous carbon materials derived from waste biomass for supercapacitors
|
Wang, Yuanyuan
|
|
|
596 |
C |
p.
|
artikel
|
| 16 |
How crucial is the role of magnetic centres in tuning magneto-resistive features of one-dimensional transition metal-based magnetic nanostructures?
|
Adak, Dipankar
|
|
|
596 |
C |
p.
|
artikel
|
| 17 |
Improved electrocatalytic performance of NdCoO3/rGO for oxygen evolution reaction
|
El-Bahy, Zeinhom M.
|
|
|
596 |
C |
p.
|
artikel
|
| 18 |
Insight into spin polarization, Fermi surface, band structure and Thermophysical properties of Sc2ZrSi inverse Heusler
|
Yousuf, Saleem
|
|
|
596 |
C |
p.
|
artikel
|
| 19 |
Magnetic properties of transition elements adsorbed B2S2 monolayers
|
Zhao, Wenxu
|
|
|
596 |
C |
p.
|
artikel
|
| 20 |
Molecular interaction and penetration depth in aqueous d-glucose below room temperature: An approach using time domain reflectometry
|
Kamble, Savita
|
|
|
596 |
C |
p.
|
artikel
|
| 21 |
Molecular simulation study on the influence of different temperatures and moisture contents on the adsorption characteristics of anthracite
|
Tang, Mingyun
|
|
|
596 |
C |
p.
|
artikel
|
| 22 |
Pressure-controlled enhancement of key physical properties for improved optoelectronic performance in MPbI3 (M = K, Tl) perovskites
|
Rony, Jahid Kabir
|
|
|
596 |
C |
p.
|
artikel
|
| 23 |
Properties of processes associated with the glass transition of water are isomorphic to those of other glass-formers
|
Ngai, K.L.
|
|
|
596 |
C |
p.
|
artikel
|
| 24 |
Studying supercapacitance properties of Mg 3 Si and Ti 3 Si as novel electrode materials: A first-principles study
|
Shirvani, Fatemeh
|
|
|
596 |
C |
p.
|
artikel
|
| 25 |
Two- and three-body dispersion coefficients for interaction of Cu and Ag atoms with Group I, II, and XII elements
|
Kaur, Harpreet
|
|
|
596 |
C |
p.
|
artikel
|
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