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Density functional theory study of calix[4]arene-N-azacrown-5, calix[4]arene-N-phenyl-azacrown-5, and their complexes with alkali-metal cations: Na+, K+, and Rb+.DFT study of the carbon- and nitrogen-pivot lariat crown ethers and their complexes with alkali metal cations: Na(+), K(+).Coarse-grained molecular dynamics simulations of photoswitchable assembly and disassembly.Stretching single polymer chains of donor-acceptor foldamers: toward the quantitative study on the extent of folding.A DFT-based QSAR study of the toxicity of quaternary ammonium compounds on Chlorella vulgaris.Theoretical Prediction of Isotope Effects on Charge Transport in Organic Semiconductors.Understanding the Charge Transport and Polarities in Organic Donor-Acceptor Mixed-Stack Crystals: Molecular Insights from the Super-Exchange CouplingsUnderstanding Lattice Strain-Controlled Charge Transport in Organic Semiconductors: A Computational StudyCharge-Transfer Complex Crystal Based on Extended-π-Conjugated Acceptor and Sulfur-Bridged Annulene: Charge-Transfer Interaction and Remarkable High Ambipolar Transport CharacteristicsMolecular Dynamics Simulations of the Supramolecular Assembly between an Azobenzene-Containing Surfactant and α-Cyclodextrin: Role of PhotoisomerizationDensity functional theory study of the potassium complexation of an unsymmetrical 1,3-alternate calix[4]-crown-5-N-azacrown-5 bearing two different crown ringsAnion-binding properties of π-electron deficient cavities in bis(tetraoxacalix[2]arene[2]triazine): a theoretical studySystematic analysis of reactivities and fragmentation of glutathione and its isomer GluCysGlyGiant anisotropic thermal expansion actuated by thermodynamically assisted reorientation of imidazoliums in a single crystalNon-aromatic annulene-based aggregation-induced emission system via aromaticity reversal processFew-Layer P4O2: A Promising Photocatalyst for Water Splitting
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description
researcher ORCID ID = 0000-0002-6584-9596
@en
wetenschapper
@nl
name
Xiaoyan Zheng
@ast
Xiaoyan Zheng
@en
Xiaoyan Zheng
@es
Xiaoyan Zheng
@nl
type
label
Xiaoyan Zheng
@ast
Xiaoyan Zheng
@en
Xiaoyan Zheng
@es
Xiaoyan Zheng
@nl
prefLabel
Xiaoyan Zheng
@ast
Xiaoyan Zheng
@en
Xiaoyan Zheng
@es
Xiaoyan Zheng
@nl
P106
P1153
35110207600
P31
P496
0000-0002-6584-9596