| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Advanced computation of enthalpies for a range of hydroformylation reactions with a predictive power to match experiments
|
Papp, Tamara
|
|
|
861 |
C |
p.
|
artikel
|
| 2 |
A theoretical perspective on the fluorescence mechanism of the H2S chemosensor 4-(2,4-dinitrophenoxy)-1,8-naphthylimide substituents
|
Hao, Wenxuan
|
|
|
861 |
C |
p.
|
artikel
|
| 3 |
Atomic-scale insights into the strength and plasticity enhancement of Ni-based superalloys with refinement dispersion of precipitates
|
Yin, Yihui
|
|
|
861 |
C |
p.
|
artikel
|
| 4 |
Conformational and vibrational contributions to configurational entropy change of a flexible peptide ligand upon binding: The role of higher-order correlations between backbone and side-chains
|
Kalathingal, Mahroof
|
|
|
861 |
C |
p.
|
artikel
|
| 5 |
Contents continued
|
|
|
|
861 |
C |
p.
|
artikel
|
| 6 |
Cytotoxicity of epoxy-encapsulated Al-doped YIG nanoparticles in MG63 osteoblast cells
|
Ortega, P.P.
|
|
|
861 |
C |
p.
|
artikel
|
| 7 |
Density functional theory predictions of properties of bioactive molecules based on guided neural network approach using semi-empirical quantum chemistry
|
Shimazaki, Tomomi
|
|
|
861 |
C |
p.
|
artikel
|
| 8 |
Determination of 35Cl electric-field-gradient tensor in polychlorotrifluoroethylene
|
Yamada, Kazuhiko
|
|
|
861 |
C |
p.
|
artikel
|
| 9 |
Editorial Board
|
|
|
|
861 |
C |
p.
|
artikel
|
| 10 |
Enhanced carriers mobility of Te atomic chain encapsulated in nanotubes
|
Han, Taikun
|
|
|
861 |
C |
p.
|
artikel
|
| 11 |
Eu-Bi3O4Br/g-C3N4 2D/2D-type heterojunction for efficient photocatalytic degradation of CO2
|
Wang, Huan-Xi
|
|
|
861 |
C |
p.
|
artikel
|
| 12 |
Excess electron binding energy approaching 15 eV in polynuclear antimony fluoride anions: From small structures to nanoparticle-sized systems
|
Freza, Sylwia
|
|
|
861 |
C |
p.
|
artikel
|
| 13 |
Graphical abstract TOC
|
|
|
|
861 |
C |
p.
|
artikel
|
| 14 |
Graphical abstract TOC
|
|
|
|
861 |
C |
p.
|
artikel
|
| 15 |
HF acid treatment induced nitrogen vacancies enriched g-C3N4 for efficient photocatalytic CO2 reduction and hydrogen production
|
Su, Xun
|
|
|
861 |
C |
p.
|
artikel
|
| 16 |
Higher-order coupled-cluster calculations with basis-set corrections
|
Mester, Dávid
|
|
|
861 |
C |
p.
|
artikel
|
| 17 |
Highly effective Pb(II) adsorption using physical–chemical double crosslinked polyvinyl alcohol-coated nano-calcium carbonate aerogel beads
|
Feng, Yao
|
|
|
861 |
C |
p.
|
artikel
|
| 18 |
Low-frequency Raman spectra of choline chloride-water mixtures
|
Ozama, Koshi
|
|
|
861 |
C |
p.
|
artikel
|
| 19 |
Molecular dynamics study on the intramolecular chain-folding pathway at early stage of constrained polymer crystallization
|
Xu, Dan
|
|
|
861 |
C |
p.
|
artikel
|
| 20 |
Nb-doped Na0.75Co0.20Mn0.78Nb0.02O2 cathode with excellent cyclability for Na-ion batteries
|
Li, Jingjie
|
|
|
861 |
C |
p.
|
artikel
|
| 21 |
Optimization and enhancing the performance of PVA-based solid polymer electrolytes for perovskite-sensitized solar cells
|
Dhumal, Supriya
|
|
|
861 |
C |
p.
|
artikel
|
| 22 |
Stability of drop-like water cluster
|
Kirov, Mikhail V.
|
|
|
861 |
C |
p.
|
artikel
|
| 23 |
Structural, electronic, and optical properties of inorganic and hybrid fullerene networks
|
Bessa, Mizraim
|
|
|
861 |
C |
p.
|
artikel
|
| 24 |
Thermally activated delayed fluorescence properties of through-space charge-transfer-type organic molecule depending on solvent polarity
|
Lee, Sang Hoon
|
|
|
861 |
C |
p.
|
artikel
|
| 25 |
Time-resolved phosphorescence analysis of singlet oxygen generation and Radachlorin/Ce6 triplet state quenching in solutions with albumin
|
Beltukova, D.M.
|
|
|
861 |
C |
p.
|
artikel
|
| 26 |
Two-dimensional RuC nanosheet as potential sensor for toxic cyanogen halides (NCX; X = H, F, Cl, Br, and I): A DFT study
|
Mahmoud, Amna H.M.
|
|
|
861 |
C |
p.
|
artikel
|
| 27 |
Using proton abstraction as a nonlinear optical amplifier in xanthone-based molecules: A DFT perspective
|
dos Santos, Neidy S.S.
|
|
|
861 |
C |
p.
|
artikel
|
| 28 |
Waste polishing powder loaded with sepiolite to extract tetracycline and copper (II) in wastewater
|
Zhu, Hexin
|
|
|
861 |
C |
p.
|
artikel
|
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