| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio investigations on non-metallic chain-shaped F n H n +1 + series of superalkali cations
|
Srivastava, Ambrish Kumar
|
|
2019
|
721 |
C |
p. 7-11
|
artikel
|
| 2 |
A first-principles study of the electronic and optical properties of monolayer α-PbO
|
Masihi, Amin
|
|
2019
|
721 |
C |
p. 27-32
|
artikel
|
| 3 |
Alpha-fluorescence (αS1) from thermally stable carbon nanodots
|
Schmitz, Rachel D.
|
|
2019
|
721 |
C |
p. 123-128
|
artikel
|
| 4 |
Catalysis mechanism of oxidized polyvinyl alcohol by pseudomonas hydrolase: Insights from molecular dynamics and QM/MM analysis
|
Chen, Jinfeng
|
|
2019
|
721 |
C |
p. 49-56
|
artikel
|
| 5 |
Coexistence of ferromagnetism and paramagnetism in ZnO/CuO nanocomposites
|
Wang, Wen
|
|
2019
|
721 |
C |
p. 57-61
|
artikel
|
| 6 |
Construction of a chemical motor-movable frame assembly based on camphor grains using water-floating 3D-printed models
|
Morohashi, Hiroaki
|
|
2019
|
721 |
C |
p. 104-110
|
artikel
|
| 7 |
Design of Gold nanorods Janus membrane for efficient and high-sensitive surface-enhanced Raman scattering and tunable surface plasmon resonance
|
Zhang, Xiaowei
|
|
2019
|
721 |
C |
p. 117-122
|
artikel
|
| 8 |
Different elements doped graphene sensor for CO2 greenhouse gases detection: The DFT study
|
Zheng, Ziqiao
|
|
2019
|
721 |
C |
p. 33-37
|
artikel
|
| 9 |
Dual level direct dynamics study of gas phase reaction of CF3CH2OCH2CF3 with Cl atoms and atmospheric degradation of CF3CH2OCH2CF3
|
Lily, Makroni
|
|
2019
|
721 |
C |
p. 141-148
|
artikel
|
| 10 |
Editorial Board
|
|
|
2019
|
721 |
C |
p. ii
|
artikel
|
| 11 |
Efficient determination of excitation energies and absorption spectra for quantum dots and large systems from ab initio data
|
Oyeniyi, Ezekiel
|
|
2019
|
721 |
C |
p. 12-17
|
artikel
|
| 12 |
Electrical tunability of molecular plasmons in acenes
|
Zhang, Kaibiao
|
|
2019
|
721 |
C |
p. 38-42
|
artikel
|
| 13 |
General up-scaled model of ligand binding with C60 fullerene clusters in aqueous solution
|
Mosunov, Andrei
|
|
2019
|
721 |
C |
p. 22-26
|
artikel
|
| 14 |
Graphical abstract TOC
|
|
|
2019
|
721 |
C |
p. IBC
|
artikel
|
| 15 |
Graphical abstract TOC
|
|
|
2019
|
721 |
C |
p. OBC
|
artikel
|
| 16 |
Initial Mn2+ binding site in photoassembly of the water-oxidizing Mn4CaO5 cluster in photosystem II as studied by quantum mechanics/molecular mechanics calculations
|
Nakamura, Shin
|
|
2019
|
721 |
C |
p. 62-67
|
artikel
|
| 17 |
Mutual cooperation of π-π stacking and pnicogen bond interactions of substituted monomeric Lawesson’s reagent and pyridine rings: Theoretical insight into Pyr||X-PhPS2⊥pyr complexes
|
Ghafari Nikoo Jooneghani, Saber
|
|
2019
|
721 |
C |
p. 91-98
|
artikel
|
| 18 |
Possible lower energy isomer of carbon clusters C n (n = 11, 12) via particle swarm optimization algorithm: Ab initio investigation
|
Shi, Lan-Ting
|
|
2019
|
721 |
C |
p. 74-85
|
artikel
|
| 19 |
Probing C⋯S chalcogen bonds in complexes SC:SHX, for X = NO2, NC, F, Cl, CN, CCH, and NH2
|
Del Bene, Janet E.
|
|
2019
|
721 |
C |
p. 86-90
|
artikel
|
| 20 |
Self-assembly behaviors of graft copolymer structured fluid droplets on flat solid surfaces
|
Wang, Jianlei
|
|
2019
|
721 |
C |
p. 43-48
|
artikel
|
| 21 |
Self-assembly of (A2B2)5 multigraft block copolymer: The length scale and phase transition
|
Zhang, Di
|
|
2019
|
721 |
C |
p. 1-6
|
artikel
|
| 22 |
Spatial separation of pyrrole and pyrrole-water clusters
|
Johny, Melby
|
|
2019
|
721 |
C |
p. 149-152
|
artikel
|
| 23 |
Spectroscopic identification of the p-ethylbenzyl radical in a corona-excited supersonic expansion
|
Huh, Chang Soon
|
|
2019
|
721 |
C |
p. 99-103
|
artikel
|
| 24 |
Synthesis of TiO2 nanotubular arrays and their electrochemical and photoelectrochemical properties to determine their use in photodegradation processes
|
Cuevas-Arteaga, C.
|
|
2019
|
721 |
C |
p. 129-140
|
artikel
|
| 25 |
Temperature dependent rectification of La0.7Sr0.3MnO3/PbZr0.2Ti0.8O3/La0.7Te0.3MnO3 perovskite p-i-n junctions with ferroelectric barrier
|
Liu, Q.
|
|
2019
|
721 |
C |
p. 68-73
|
artikel
|
| 26 |
The ground and excited low-lying states of VSi2 0/−/+ clusters from CASSCF/CASPT2 calculations
|
Nguyen, Minh Thao
|
|
2019
|
721 |
C |
p. 111-116
|
artikel
|
| 27 |
The impacts of operating pressure on the structural and magnetic properties of HfCo7 nanoparticles synthesized by inert gas condensation
|
Wang, Tingting
|
|
2019
|
721 |
C |
p. 18-21
|
artikel
|
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