| 1 |
Chemisorption - Induced 2D – 3D – 2D Structural Transitions in Gold Heptamer :(CO) n Au7–(n= 1–4)
|
期刊论文 |
R Pal|W Huang|YL Wang|HS Hu...| |
| 2 |
A Water - Promoted Mechanism of Alcohol Oxidation on Au ( 111 ) Surface : Understanding toward the Catalytic Behavior of Bulk Gold
|
期刊论文 |
CR Chang|X Yang|B Long|J Li| |
| 3 |
Probing the electronic structure and chemical bonding of the “ staple ” motifs of thiolate gold nanoparticles : Au ( SCH3 ) 2 ? and Au2 ( SCH3 ) 3 ?
|
期刊论文 |
CG Ning|XG Xiong|YL Wang|J Li...| |
| 4 |
Matrix Isolation Spectroscopic and Theoretical Study of Water Adsorption and Hydrolysis on Molecular Tantalum and Niobium Oxides
|
期刊论文 |
M Zhou|J Zhuang|G Wang|M Chen| |
| 5 |
Planar Hexagonal B36 As A Potential Basis for Extended Single-Atom Layer Boron Sheets
|
期刊论文 |
Z. A. Piazza|H.-S. Hu|W.-L. Li|Y.-F. Zhao|J. Li|L.-S. Wang| |
| 6 |
Photoelectron Imaging and Spectroscopy of MI2 ?( M = Cs , Cu , Au ): Evolution from Ionic to Covalent Bonding ?
|
期刊论文 |
YL Wang|XB Wang|XP Xing|F Wei|J Li...| |
| 7 |
Electronic Spectra and Excited States of Neptunyl and Its [NpO2Cl4](2-) Complex
|
期刊论文 |
Su, Jing|Schwarz, W. H. E.|Li, Jun| |
| 8 |
Matrix Isolation Spectroscopic and Theoretical Study of Carbon Dioxide Activation by Titanium Oxide Molecules
|
期刊论文 |
J Zhuang|ZH Li|K Fan|M Zhou| |
| 9 |
The mixed cyanide halide Au ( i ) complexes ,?( X = F , Cl , Br , and I ): evolution from ionic to covalent bonding
|
期刊论文 |
HT Liu|XG Xiong|PD Dau|YL Wang|J Li...| |
| 10 |
Photoelectron spectroscopy and theoretical studies of UF5 - and UF6-
|
期刊论文 |
Dau, Phuong Diem1|Su, Jing2|Liu, Hong-Tao1|Huang, Dao-Ling1|Wei, Fan2|Li, Jun2|Wang, Lai-Sheng1| |
| 11 |
Probing the electronic structures of low oxidation-state uranium fluoride molecules UFx (-) (x = 2-4).
|
期刊论文 |
Li, Wei-Li|Hu, Han-Shi|Jian, Tian|Lopez, Gary V|Su, Jing|Li, Jun|Wang, Lai-Sheng| |
| 12 |
A Joint Photoelectron Spectroscopy and Theoretical Study on the Electronic Structure of UCl5? and UCl5
|
期刊论文 |
J Su|PD Dau|CF Xu|DL Huang|HT Liu...| |
| 13 |
Density functional theory investigations on the catalytic mechanisms of hydrazine decompositions on Ir ( 111 )
|
期刊论文 |
PX Zhang|YG Wang|YQ Huang|T Zhang|GS Wu|J Li| |
| 14 |
Advances of computational actinoid chemistry in China
|
期刊论文 |
D. Wang|J. Su|J. Wu|J. Li|Z. Chai| |
| 15 |
Photoelectron Imaging of Ag –( H2O ) x and AgOH –( H2O ) y ( x = 1 , 2 , y = 0 – 4 )
|
期刊论文 |
C Chi|H Xie|Y Li|R Cong|M Zhou...| |
| 16 |
Matrix Isolation Infrared Spectroscopic and Theoretical Study of the Reactions of Tantalum Oxide Molecules with Methanol
|
期刊论文 |
G Wang|J Zhuang|M Zhou| |
| 17 |
Theoretical Study of the Luminescent States and Electronic Spectra of UO2Cl2 in an Argon Matrix
|
期刊论文 |
Su, Jing|Wang, Yi-Lei|Wei, Fan|Schwarz, W. H. E.|Li, Jun| |
| 18 |
Oxidation States, Geometries, and Electronic Structures of Plutonium Tetroxide PuO4 Isomers: Is Octavalent Pu Viable?
|
期刊论文 |
Huang, Wei|Xu, Wen-Hua|Su, Jing|Schwarz, W H E|Li, Jun| |
| 19 |
Photoelectron spectroscopy and the electronic structure of the uranyl tetrachloride dianion: UO2Cl42-
|
期刊论文 |
Dau, Phuong Diem1|Su, Jing2|Liu, Hong-Tao1|Huang, Dao-Ling1|Li, Jun2|Wang, Lai-Sheng1| |
| 20 |
A Tetrapositive Metal Ion in the Gas Phase : Thorium ( IV ) Coordinated by Neutral Tridentate Ligands
|
期刊论文 |
Y Gong|HS Hu|G Tian|L Rao|J Li...| |
| 21 |
Vibrationally resolved photoelectron spectroscopy of di-gold carbonyl clusters Au2(CO)n- (n = 1-3): experiment and theory.
|
期刊论文 |
Wang, Yi-Lei|Zhai, Hua-Jin|Xu, Lu|Li, Jun|Wang, Lai-Sheng| |
| 22 |
Geometries , electronic structures , and excited states of UN2, NUO+, and UO 2 2+: a combined CCSD (T), RAS/CASPT2 and TDDFT study
|
期刊论文 |
F Wei|G Wu|WHE Schwarz|J Li| |
| 23 |
Electron Affinities of the Early Lanthanide Monoxide Molecules
|
期刊论文 |
C Chi|H Xie|R Cong|Z Tang...| |
| 24 |
Adsorption-induced structural changes of gold cations from two- to three-dimensions.
|
期刊论文 |
Yang, Xiao-Feng|Wang, Yi-Lei|Zhao, Ya-Fan|Wang, Ai-Qin|Zhang, Tao|Li, Jun| |
| 25 |
... - Glycine - Water Complexes in Solution : Comprehensive Computational Modeling of Coordination Geometries , Stabilization Energies , and Luminescence Properties
|
期刊论文 |
J Su|K Zhang|WHE Schwarz|J Li| |
| 26 |
Actinide-Silicon Multiradical Bonding: Infrared Spectra and Electronic Structures of the Si(mu-X)AnF3 (An = Th, U; X = H, F) Molecules.
|
期刊论文 |
Hu, Han-Shi|Wei, Fan|Wang, Xuefeng|Andrews, Lester|Li, Jun| |
| 27 |
Unusual selectivity of gold catalysts for hydrogenation of 1 , 3 - butadiene toward cis - 2 - butene : A joint experimental and theoretical investigation
|
期刊论文 |
XF Yang|AQ Wang|YL Wang|T Zhang...| |
| 28 |
Experimental and Theoretical Studies on the Fragmentation of Gas - Phase Uranyl–, Neptunyl–, and Plutonyl–Diglycolamide Complexes
|
期刊论文 |
Y Gong|HS Hu|L Rao|J Li...| |
| 29 |
Theoretical studies on the complexation of uranyl with typical carboxylate and amidoximate ligands
|
期刊论文 |
CF Xu|J Su|X Xu|J Li| |
| 30 |
Observation and investigation of the uranyl tetrafluoride dianion (UO 2F42-) and its solvation complexes with water and acetonitrile
|
期刊论文 |
Dau, Phuong Diem1|Su, Jing2|Liu, Hong-Tao1|Liu, Jian-Biao2|Huang, Dao-Ling1|Li, Jun2|Wang, Lai-Sheng1| |
| 31 |
Probing the Electronic Structure and Chemical Bonding in Tricoordinate Uranyl Complexes UO2X3–(X= F, Cl, Br, I): Competition between Coulomb Repulsion and U– ...
|
期刊论文 |
J Su|PD Dau|YH Qiu|HT Liu|CF Xu...| |
| 32 |
The electronic structure and chemical bonding in gold dihydride: AuH 2- and AuH2
|
期刊论文 |
Liu, Hong-Tao1|Wang, Yi-Lei2|Xiong, Xiao-Gen2|Dau, Phuong Diem1|Piazza, Zachary A.1|Huang, Dao-Ling1|Xu, Cong-Qiao2|Li, Jun2|Wang, Lai-Sheng1| |
| 33 |
Formation and Characterization of Two Interconvertible Side - On and End - On Bonded Beryllium Ozonide Complexes
|
期刊论文 |
Z Zhou|Y Li|J Zhuang|G Wang|M Chen...| |
| 34 |
Theoretical Study of Syngas Hydrogenation to Methanol on the Polar Zn-Terminated ZnO(0001) Surface
|
期刊论文 |
Zhao, Ya-Fan|Rousseau, Roger|Li, Jun|Mei, Donghai| |
| 35 |
Photoelectron Imaging of AgOCH3 - and Ag-(CH3OH) x (x= 1, 2)
|
期刊论文 |
池超贤|谢华|从然|唐紫超|周鸣飞| |
| 36 |
Probing the nature of gold-carbon bonding in gold-alkynyl complexes.
|
期刊论文 |
Liu, Hong-Tao|Xiong, Xiao-Gen|Dau, Phuong Diem|Wang, Yi-Lei|Huang, Dao-Ling|Li, Jun|Wang, Lai-Sheng| |
| 37 |
Deduction of Bond Length Changes of Symmetric Molecules from Experimental Vibrational Progressions , Including a Topological Mass Factor §
|
期刊论文 |
J Su|F Wei|WHE Schwarz|J Li| |
| 38 |
Theoretical investigations of the catalytic role of water in propene epoxidation on gold nanoclusters : A hydroperoxyl - mediated pathway
|
期刊论文 |
CR Chang|YG Wang|J Li| |
| 39 |
On the maximum bond multiplicity of carbon: Unusual CU quadruple bonding in molecular CUO
|
期刊论文 |
Hu, Han-Shi1, 2|Qiu, Yi-Heng1|Xiong, Xiao-Gen1|Schwarz, W. H. Eugen1|Li, Jun1| |
| 40 |
Aurophilic attractions between a closed - shell molecule and a gold cluster
|
期刊论文 |
P Pyykk?|XG Xiong|J Li| |
| 41 |
Matrix Infrared Spectroscopic and Computational Investigations of the Lanthanide ? Methylene Complexes CH2LnF2 with Single Ln ? C Bonds
|
期刊论文 |
X Wang|HG Cho|L Andrews|M Chen...| |
| 42 |
Excited States and Absorption Spectra of UF6 : A RASPT2 Theoretical Study with Spin – Orbit Coupling
|
期刊论文 |
F Wei|GS Wu|WHE Schwarz|J Li| |
| 43 |
Evidence of Significant Covalent Bonding in Au(CN)2-
|
期刊论文 |
Xue-Bin Wang|Yi-Lei Wang|Jie Yang|Xiao-Peng Xing|Jun Li|Lai-Sheng Wang| |
| 44 |
Quadruple boding of carbon in terminal carbides
|
期刊论文 |
Y.-H. Qiu|H.-S. Hu|G. Chen|J. Li| |
| 45 |
Theoretical Investigations of Geometry , Electronic Structure and Stability of UO6 : Octahedral Uranium Hexoxide and Its Isomers ?
|
期刊论文 |
H Xiao|HS Hu|WHE Schwarz|J Li| |
| 46 |
Titanium Oxide Complexes with Dinitrogen . Formation and Characterization of the Side - On and End - On Bonded Titanium Oxide – Dinitrogen Complexes in Solid Neon
|
期刊论文 |
M Zhou|J Zhuang|Z Zhou|ZH Li|Y Zhao...| |
| 47 |
Chemistry on Single Atoms : Spontaneous Hydrogen Production from Reactions of Transition ‐ Metal Atoms with Methanol at Cryogenic Temperatures
|
期刊论文 |
G Wang|J Su|Y Gong|M Zhou...| |
| 48 |
Rare-earth monocarbonyls MCO: Comprehensive infrared observations and a transparent theoretical interpretation for M = Sc; Y; La-Lu
|
期刊论文 |
Xu, Wenhua1|Jin, Xi2|Chen, Mohua2|Pyykkö, Pekka1, 3|Zhou, Mingfei2|Li, Jun1| |
| 49 |
Is rhodium tetroxide in the formal oxidation state VIII stable ? a quantum chemical and matrix isolation investigation of rhodium oxides
|
期刊论文 |
Y Gong|M Zhou|L Andrews|T Schl?der...| |
| 50 |
On Two Different Objectives of the Concepts of Ionic Radii
|
期刊论文 |
JB Liu|WH Schwarz|J Li| |
| 51 |
Insight into methanol synthesis from CO2 hydrogenation on Cu(111): Complex reaction network and the effects of H2O
|
期刊论文 |
Zhao, Ya-Fan|Yang, Yong|Mims, Charles|Peden, Charles H. F.|Li, Jun|Mei, Donghai| |
| 52 |
Theoretical Studies on the Photoelectron and Absorption Spectra of MnO4 – and TcO4–
|
期刊论文 |
J Su|WH Xu|CF Xu|WHE Schwarz|J Li| |
| 53 |
The electronic structure and chemical bonding in gold dihydride: AuH 2- and AuH2
|
期刊论文 |
Liu, Hong-Tao1|Wang, Yi-Lei2|Xiong, Xiao-Gen2|Dau, Phuong Diem1|Piazza, Zachary A.1|Huang, Dao-Ling1|Xu, Cong-Qiao2|Li, Jun2|Wang, Lai-Sheng1| |
