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副高级
Supervisor of Master's Candidates
Paper Publications
Supramolecules applied to energy storage devices: Study on the mechanism of cucurbituril inhibition of the polysulfide shuttle effect..ChemistrySelect,
Efficient molecular recognition of polycyclic aromatic hydrocarbons by X-diimide-pillar[4,6]arenes.Computational and Theoretical Chemistry,
New insight into the structural stability of large POSS by quantum chemistry calculation.Inorganic Chemistry Communications,
The stabilization effects of macrocyclic hosts on novel sandwich dimers M2Cp2 (M = Be and Mg) and their fluoro derivatives..Chemical Physics Letters,
Silicene/BN heterostructure as high-performance anode material for Mg-ion batteries..Materials Today Communications,
Supramolecules applied to energy storage devices: Study on the mechanism of cucurbituril inhibition of the polysulfide shuttle effect.ChemistrySelect,10e202405238.
Xie Ju,席紫晴,杨炎武,张学成,杨振山,何茂霞.Computational investigation of the structures, properties, and host-guest chemistry of prism[n]arenes.INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,2024,124(1)
Xie Ju,王婉婷,席紫晴,张学成,杨振山,原赫,何茂霞.Thiapillar[5]arenes: Structures, Properties, and Host-Guest chemistry.CHEMICAL PHYSICS,2024,581
Xie Ju,梁泉艺,刘博扬,席紫晴,杨振山,张学成,原赫,张彤云.Molecular mechanism of alkene hydrosilylation in the molecular cavity of cucurbituril.COMPUTATIONAL AND THEORETICAL CHEMISTRY,2023,1226
Xie Ju,席紫晴,杨振山,张学成,原赫,杨炎武,倪鲁彬,何茂霞.Computational approach to understanding the structures, properties, and supramolecular chemistry of pagoda[n]arenes.JOURNAL OF MOLECULAR STRUCTURE,2023,1281
Xie Ju,杨炎武,席紫晴,杨振山,张学成,倪鲁彬.Cyclized oligomer of tetracyanoquinodimethane-tetrathiafulvalene (TCNQ-TTF): a versatile macrocyclic molecule by DFT calculations.JOURNAL OF INCLUSION PHENOMENA AND MACROCYCLIC CHEMISTRY,2022,102(9-10)751-761.
Xie Ju,石慧中,沈超,还龙,何茂霞,陈铭.Heteroatom-bridged pillar[4]quinone: evolutionary active cathode material for lithium-ion battery using density functional theory.JOURNAL OF CHEMICAL SCIENCES,2021,133(1)
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