Scientific Research

Research Field

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Paper Publications

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• DFT study of [BH4] (-) rotation in pressure-driven phase transition of MBH4 .COMPUTATIONAL MATERIALS SCIENCE .2018 :卷: 154 页: 143-146
• Be12O12 Nano-cage as a promising catalyst for CO2 hydrogenation .Scientific reports .2016 :7:40562
• Intercalated aromatic molecule effect on super-hard C20 fullerene materials .Diamond Relat. Mat. .2015 :v 55,p139-143
• A Novel Cobalt(III) Complex with Macrocyclic Triamine Ligand for High Capacity Hydrogen Adsorption .CHINESE JOURNAL OF STRUCTURAL CHEMISTRY .2012 :卷: 31 期: 9 页: 1322-1328
• All-Metal Aromatic Sandwich Binuclear Complexes: Electronic Structures, Aromaticity and Interactions with Hydrogen via Multicenter Bonds .CHEMISTRYSELECT .2017 :卷: 2 期: 22 页: 6206-6211
• Tunable dipole induced hydrogen bonds between a hydrogen molecule and alkali halides. .Phys. Chem. Chem. Phys. .2015 :17

Patents

• 一种Li3PO4纳米晶的制备方法

Published Books

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Research Projects

• 基于偶极诱导型氢键作用的储氢材料设计及性能研究 , 2017-12-01 , 进行
• 基于第一性原理的高效储氢分子设计、储氢性能及机理研究 , 2012-01-01