| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A computational investigation of the effects of changes of donor–acceptor linker length and acceptor on electronic spectra of small-molecule single-component organic solar cells
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Liu, Kaikai
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|
|
579 |
C |
p.
|
artikel
|
| 2 |
A DFT study on photodissociation of the palladium tetrachloride anion PdCl4 2− in solution
|
Anzai, Aiko
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|
579 |
C |
p.
|
artikel
|
| 3 |
Analysis of electron configurations in terms of parity-supporting rotations returns the hydrogen spectrum with consequences for the orbital model
|
Ogrodowicz, Roksana
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|
579 |
C |
p.
|
artikel
|
| 4 |
An insight into fine cassiterite recovery: A novel surfactant-phenylpropylhydroxamic acid and its adsorption mechanism
|
Zhang, Mei
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|
|
579 |
C |
p.
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artikel
|
| 5 |
Bright, blue fluorescent carbon dots for sensitive and selective detection of folic acid
|
Cai, Zhifeng
|
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|
579 |
C |
p.
|
artikel
|
| 6 |
Cross-linkable fluorene-based hole transporting materials for perovskite solar cells
|
Kamarauskas, Egidijus
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|
579 |
C |
p.
|
artikel
|
| 7 |
Density functional theory investigations on the mechanisms of homogeneous Sm complex catalyzed CO 2 cycloaddition with epoxides
|
Xu, Wenhua
|
|
|
579 |
C |
p.
|
artikel
|
| 8 |
2D Janus piezoelectric iridium trihalide Ir2X3Y3 with potential application in photocatalysts for water splitting
|
Feng, Ying-Xue
|
|
|
579 |
C |
p.
|
artikel
|
| 9 |
Doping effects in the alanine-black phosphorene interactions: First principles studies
|
Calvario-Coyotl, Javier
|
|
|
579 |
C |
p.
|
artikel
|
| 10 |
Dynamics and energetics of the K( 2 S ) + H 2 ( X 1 Σ g + ) reaction: Significance of orientational and (ro)vibrational contribution
|
Yeswanth Kumar, Santhakumar
|
|
|
579 |
C |
p.
|
artikel
|
| 11 |
Editorial Board
|
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|
|
579 |
C |
p.
|
artikel
|
| 12 |
Exploiting the Bi-doping effect on the properties of NaNbO3 perovskite -type materials
|
Vlazan, Paulina
|
|
|
579 |
C |
p.
|
artikel
|
| 13 |
Exploring the feasibility of hexa-peri-hexabenzocoronene nanographene and its doped analogues for Ca-ion Batteries: A density functional theory investigation
|
Buenaño, Luis
|
|
|
579 |
C |
p.
|
artikel
|
| 14 |
First-principles investigation on electronic and photocatalytic behavior of GaSe1-xTex/MoS2 heterojunction
|
Liu, Jianjun
|
|
|
579 |
C |
p.
|
artikel
|
| 15 |
Formation of catalyst particles for the CNT growth from thin films: Experiment and simulation
|
Bulyarskiy, S.
|
|
|
579 |
C |
p.
|
artikel
|
| 16 |
Formation Onset of Flat-Perylene Prenucleation Clusters in Vacuum
|
Husanova, Dilfuza
|
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|
579 |
C |
p.
|
artikel
|
| 17 |
Gibbs equilibrium conditions and the thermodynamic limit
|
Zabashta, Yuri F.
|
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|
579 |
C |
p.
|
artikel
|
| 18 |
Graphical abstract TOC
|
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|
579 |
C |
p.
|
artikel
|
| 19 |
Graphical abstract TOC
|
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|
579 |
C |
p.
|
artikel
|
| 20 |
Graphical abstract TOC
|
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|
579 |
C |
p.
|
artikel
|
| 21 |
High-accuracy solution of the Dirac equation for three-dimensional hydrogen atom using a variationally optimized diagonalization method
|
Wu, Shudong
|
|
|
579 |
C |
p.
|
artikel
|
| 22 |
Improved melting temperature predictions for single LNA modifications in synthetic DNA oligonucleotides
|
Ferreira, Izabela
|
|
|
579 |
C |
p.
|
artikel
|
| 23 |
Investigation of Diazinon degradation via advanced photocatalysis of CoWO4/g-C3N4 Z scheme heterojunction with addition of H2O2
|
Minh Anh, Tran
|
|
|
579 |
C |
p.
|
artikel
|
| 24 |
Kinetic studies of surfactant-aspirin micellization by means of ultrasonic relaxation spectroscopy
|
Kouderis, C.
|
|
|
579 |
C |
p.
|
artikel
|
| 25 |
Machine learning assisted prediction of copper-based catalysts towards carbon dioxide electroreduction into carbon monoxide
|
Wei, Shuaichong
|
|
|
579 |
C |
p.
|
artikel
|
| 26 |
Mesopore engineering of Co3O4 nanoplates for enhanced detection of toluene vapor
|
Yang, Wei
|
|
|
579 |
C |
p.
|
artikel
|
| 27 |
Microscopic mechanism of CO2 adsorption on M2+ (M = Fe, Ca, Mg)-doped kaolinite (001) surface: DFT calculations
|
Chen, Jun
|
|
|
579 |
C |
p.
|
artikel
|
| 28 |
Nanotubular TiO2 films sensitized with CdTe quantum dots: Stability and adsorption distribution
|
Asenjo Collao, Andrés M.
|
|
|
579 |
C |
p.
|
artikel
|
| 29 |
Physical properties and Raman spectroscopy inquiry of copper laden bio-relevant calcium phosphate glasses and the exposed to γ-irradiation
|
Jiménez, José A.
|
|
|
579 |
C |
p.
|
artikel
|
| 30 |
Proposing a plausible molecular structure for Ice XI: A coupled study using Rietveld refinement and Density Functional Theory
|
Biggs, Christina M.B.
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|
579 |
C |
p.
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artikel
|
| 31 |
Raman spectroscopy of active-carbon electrodes when Au colloids are placed at the electrolyte/electrode interface
|
Grebel, H.
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|
579 |
C |
p.
|
artikel
|
| 32 |
ReaxFF molecular dynamics simulation on the combustion mechanism of toluene/ethanol/n-heptane mixed fuel
|
Xu, Chun-Chen
|
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|
579 |
C |
p.
|
artikel
|
| 33 |
Simulation research of localized surface plasmon sensor based on gold nanocone hexagonal array structure
|
Hongyu, Wang
|
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|
579 |
C |
p.
|
artikel
|
| 34 |
Study of photo-induced charge transfer properties in Cs3Bi2I9/BiFeO3/TiO2 film
|
Ren, Xuecheng
|
|
|
579 |
C |
p.
|
artikel
|
| 35 |
Study on flocculation performance and mechanism of cationic polyacrylamide on montmorillonite: Insights from experiments and molecular simulations
|
Zhang, Lianfeng
|
|
|
579 |
C |
p.
|
artikel
|
| 36 |
Synthesis and physical properties of new 1,6-diazabicyclo[4.1.0]heptanes: Quantum-chemistry calculations and crystal structures simulations
|
Kuznetsov, V.V.
|
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|
579 |
C |
p.
|
artikel
|
| 37 |
The adsorption of tetracycline, ciprofloxacin on reduced graphene oxide surfaces: Role of intermolecular interaction
|
Ngoc Tri, Nguyen
|
|
|
579 |
C |
p.
|
artikel
|
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