Supported by the National Natural Science Foundation of China(No.51602310);Fujian Provincial Department of Science and Technology(2019T3017);the DNL Cooperation Fund,CAS(DNL180308)。
Lithium ion battery cathode material LiNi0.8Co0.1Mn0.1O2(NCM811)was synthe-sized via a spray drying method.The effect of different spray drying flow-rates(200,250,300,and 400 mL·min^-1)on the structural and electroch...
Using transition-metal-complex cation as the structure-directing agent, a novel one-dimensional(1D) iodoargentate-based hybrid, namely, {[Co(2,2’-bipy)3]2(Ag7I11)·3H2O}n(1) has been synthesized and structurally char...
supported by the National Natural Science Foundation of China(No.51504117,61764009,51762043);Yunnan Youth Fund Project(2016FD037);Talent Development Program of KUST(KKSY201563032);the Program for Innovative Research Team in University of Ministry of Education of China(No.IRT_17R48)
This work reports the mechanism of benzimidazoledithi(BDT) derivatives’ selective pre-enrichment of Cd2+under the stimulation of glutathione(GSH). The geometric and electronic properties of five BDT-M2+complexes(M = ...
Supported by the NNSFC(No.21373223);Chunmiao project of Haixi Institute of Chinese Academy of Sciences(CMZX-2014-001)
With transition metal complex, a discrete cuprous iodide compound, namely, [Ni(phen)3]2Cu6I10(1, phen = 1,10-phenanthroline) has been solvothermally synthesized and structurally characterized. Single-crystal X-ray...
supported by the NNSFC (20973174);the Young Scientist Fund of NSFC (81001403);the Youth Innovation Fund;the Institute Key Program (SZD08003) of FJIRSM
Theoretical study was performed to investigate how the hydration of cadmium ca-tion influences the structure and properties of guanine.The aqueous environment was simulated by both explicit solvent(1-5 water molecule...
Two polymorphs of the inclusion compound [(n-C4H9)4N]+'(C13H903)H2O have been prepared and characterized by X-ray crystallography. Polymorph 1: triclinic P1, a = 13.4982(2), b = 13.5743(2), c = 17.1996(2)...
Suppoted by the Science Foundation of Qujing Normal School (No. 2008QN004);the Scientific Research Fund of Yunnan Provincial Education (No. 09C0187);the Scientific Research Fund of Yunnan Provincial Education (No. 09Y0392)
To elucidate the mechanisms of Zr + reacting with COS,both the quartet and doublet potential energy surfaces (PESs) for reactions of Zr + (4 F,2 D) with COS in the gas phase have been investigated in detail by m...
Supported by NNSFC (20563005);the General Program of the Applied Basic Research of Science and Technology Department of Yunnan Province (No. 2008ZC095)
The possible reaction mechanisms of FeS+(6Σ+ and 4Ф states) with COS in the gas phase have been studied by using density functional theory at the B3LYP/TZVP and B3LYP/6-311+G* levels:the O/S exchange reaction...
Supported by the General Program of the Applied Basic Research of Science and Technology Department of Yunnan Province (No.2008ZC095);the Scientific Research Fund of Yunnan Provincial Education Department (No.08Y0195);supported by the Key Laboratory of Forest Resources Conservation and Use in the Southwest Mountains of China (Southwest Forestry University)
The reaction of Au+(1S,3D) with CS2 has been investigated at the B3LYP and CCSD(T) levels of theory.The identified reaction pathways revealed that the experimentally observed products,AuS+ and AuCS+,can be prod...
Supported by the National Natural Science Foundation of China (No. 20771006);Natural Science Foundation of Anhui Province (No. 2006kj042a);Education Committee of Anhui Province (KJ2008B005)
A novel compound [(CNBz)2Im]2(TCNQ)3(CH3CN)((CNBz)2Im = 1,3-bis(4-cyano-benzyl) imidazole cation,TCNQ-1 = 7,7,8,8-tetracyanoquinodimethanide anion) was synthesized by the reaction of [(CNBz)2Im]Br and Li...