| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
An electronic approach to understanding the kinetics of hydrogen peroxide formation
|
Ashurov, M.H.
|
|
|
597 |
C |
p.
|
artikel
|
| 2 |
Contents continued
|
|
|
|
597 |
C |
p.
|
artikel
|
| 3 |
Cross sections for scattering of excited argon atoms on helium atom
|
Pershin, A.
|
|
|
597 |
C |
p.
|
artikel
|
| 4 |
Design and performance study of nitrogen-containing cuneane derivatives
|
Tang, Dongrun
|
|
|
597 |
C |
p.
|
artikel
|
| 5 |
Editorial Board
|
|
|
|
597 |
C |
p.
|
artikel
|
| 6 |
Enhancing photocatalytic performance for H2O2 production by constructing triazine-heptazine-based carbon nitride and coupling lignin CC bond cleavage
|
Liu, Man
|
|
|
597 |
C |
p.
|
artikel
|
| 7 |
Exploring the thermodynamic stability and electronic structure of ZnNb₂O₆(001) surface through first-principles calculations
|
Yang, Anqi
|
|
|
597 |
C |
p.
|
artikel
|
| 8 |
First principle investigation of the structural, optoelectronic, mechanical and thermoelectric performance of Nb-Ti co-doped ZrO2
|
Jawad, Muhammad
|
|
|
597 |
C |
p.
|
artikel
|
| 9 |
First-principles calculations study:The tunability and optical properties of the ZrS2/CdSe heterojunction
|
Li, Dan
|
|
|
597 |
C |
p.
|
artikel
|
| 10 |
First-principles calculations to investigate structural, electronic, elastic and thermal properties of Mg doped Ti2Ni intermetallics
|
Wang, Yuqi
|
|
|
597 |
C |
p.
|
artikel
|
| 11 |
First-principles study of hydrazinium nitroformate and Copper(I) 5-nitrotetrazolate: Eco-friendly substitutes for ammonium dinitramide and lead azide
|
Jharapla, Prathap Kumar
|
|
|
597 |
C |
p.
|
artikel
|
| 12 |
Graphical abstract TOC
|
|
|
|
597 |
C |
p.
|
artikel
|
| 13 |
Graphical abstract TOC
|
|
|
|
597 |
C |
p.
|
artikel
|
| 14 |
Influence of electrodes in enhancing the thermoelectric performance of Mn-Cn-Mn (n = 7) molecular chain
|
Mitra, Shankar Prasad
|
|
|
597 |
C |
p.
|
artikel
|
| 15 |
Influences of secondary and tertiary amines in epoxy resins on water dynamics by all-atomic molecular dynamics simulations
|
Higuchi, Yuji
|
|
|
597 |
C |
p.
|
artikel
|
| 16 |
Intrinsic thermoelectric performance enhancement of bi₂Al₄S₈ via carrier concentration and chemical potential engineering
|
Ghellab, T.
|
|
|
597 |
C |
p.
|
artikel
|
| 17 |
Investigating nitrogen molecule adsorption on borophene surface using reactive molecular dynamics simulation
|
Sababkar, Mahnaz
|
|
|
597 |
C |
p.
|
artikel
|
| 18 |
Investigation on optical illumination effect on transport properties and resistive switching of poly crystalline BiFeO3/ITO heterojunction
|
Rathod, H.K.
|
|
|
597 |
C |
p.
|
artikel
|
| 19 |
Investigation on the effect of surface orientations on helium behavior using first-principles
|
Wen, ShuLong
|
|
|
597 |
C |
p.
|
artikel
|
| 20 |
Modeling the effects of thermal fluctuations on proton tunneling kinetics in systems with intermolecular hydrogen bonding
|
Nanni, Luca
|
|
|
597 |
C |
p.
|
artikel
|
| 21 |
Molecular dynamics simulations based on the diffusion interface of solid-phase Ti–Al system
|
Zhang, Jianwei
|
|
|
597 |
C |
p.
|
artikel
|
| 22 |
Spinel-type nickel iron oxide anchored on conducting polymer PANI: A novel electrocatalyst for hydrogen evolution reaction (HER)
|
Faiz, Ayesha
|
|
|
597 |
C |
p.
|
artikel
|
| 23 |
The activity and selectivity in CO2 to HCOOH conversion on TM-G-N4 with axially coordinated nonmetal
|
Wang, Wenjie
|
|
|
597 |
C |
p.
|
artikel
|
| 24 |
Theoretical calculation of single-atom supported BN catalyzing CO2 hydrogenation to formic acid: A first principles study
|
Naimatullah,
|
|
|
597 |
C |
p.
|
artikel
|
| 25 |
Theoretical study on the effect of H2O and ionic liquid on CO2 reduction on Cu surface
|
Zhang, Zhiqi
|
|
|
597 |
C |
p.
|
artikel
|
| 26 |
The photoelectric properties of 2D ZnO/black phosphorus heterostructures with different electric field
|
Zhao, Yanfang
|
|
|
597 |
C |
p.
|
artikel
|
| 27 |
Thermodynamics of free radical scavenging activity of deprotonated hibiscetin towards reactive oxygen and nitrogen species
|
Ragi, C.
|
|
|
597 |
C |
p.
|
artikel
|
| 28 |
Understanding the superior stability and enhanced physical performance of tetragonal XH2 (X = Y, Zr) hydrides over their cubic counterparts via ab-initio computational investigation
|
Islam, Minhajul
|
|
|
597 |
C |
p.
|
artikel
|
| 29 |
Vibrational dynamics in solid methanol investigated through inelastic neutron scattering and molecular dynamics simulations
|
Colognesi, Daniele
|
|
|
597 |
C |
p.
|
artikel
|
| 30 |
ZnI2/SnS2 van der Waals heterojunction: A high-efficiency direct Z-type photocatalyst for overall water-splitting predicted from first-principles calculation
|
Zhang, Yan
|
|
|
597 |
C |
p.
|
artikel
|
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