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              Research Publications

 

200. Size-Selected Anion Photoelectron Spectroscopy and Density Functional Theory Calculations of Ferromagnetic Fe2Cn−/0 (n=2–6) Clusters              
     Xi-Long Li, Zhen-Chao Long, Kai-Wen Liu, Baibai Wan, Xi-Ling Xu, Hong-Guang Xu, and Weijun Zheng              
                   Phys. Chem. Chem. Phys. 27, 8813-8823 (2025).   https://doi.org/10.1039/D5CP00662G              
             
199. An Experimental and Theoretical Study of the Photoionization Properties of Polysulfanes (H2Sn, n=2–4)              
     Zhibiao Li, Jianchao Yang, Xinyue Gong, Weijun Zheng, Chongqin Zhu, Cheng Zhu              
                   Phys. Chem. Chem. Phys. 27, 5961-5964 (2025).   https://doi.org/10.1039/D4CP04870A              
             
198. The structural resemblance between InSin− and Sin+1 (n=3-11): anion photoelectron spectroscopy and density functional calculations              
     Zhao-Ou Gao, Xiling Xu, Umar Farooq, Hong-Guang Xu, and Weijun Zheng              
                   J. Chem. Phys. 162, 114302 (2025).    https://doi.org/10.1063/5.0253378              
             
197. Structures and proton transfer processes of methionine effected by heavy metal cations (Pb2+, Hg2+, and As3+) in the gas phase and aqueous solution              
     Yi-Jia Wang, Lei Hu, Lei Hua, Ren-Zhong Li, Hong-Guang Xu, Wei-Jun Zheng              
                   Comput. Theor. Chem. 1244, 115071 (2025).    https://doi.org/10.1016/j.comptc.2025.115071              
             
196. High-Nitrogen-Content Energetic BNn+ (n=4-16) Clusters              
     Jia-Le Li, Meicheng Chen, Kai-Wen Liu, Kewei Ding, Hong-Guang Xu, Weijun Zheng, and Cheng Lu              
                   Phys. Chem. Chem. Phys. 27, 3567-3573 (2025).    https://doi.org/10.1039/D4CP03566F              
             
195. Characterizing Metal Carbide Structures: Insights from Photoelectron Spectroscopy and Density Functional Theory              
     Majid Ali, Umar Farooq, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng              
                   Coordination Chem. Rev. 522, 216197 (2025).     https://doi.org/10.1016/j.ccr.2024.216197              
             
194. Planar Tetracoordinate Silicon in Cu3Si3− Cluster              
     Xiao-Han Yin, Hong-Lin Zeng, Xin-Bo Liu, Xi-Ling Xu, Hong-Guang Xu, Gabriel Merino, Wei-Jun Zheng, Zhong-Hua Cui              
                   Angew. Chem. Int. Ed. 64, e202415789 (2025).                  https://doi.org/10.1002/anie.202415789              
             
193. 重要小分子的光解离和光电离微观动力学 The Photodissociation and Photoionization Dynamics of Some Important Small Molecules              
     程敏, 张丽娟, 徐西玲, 高蕻, 郑卫军   Min Cheng, Lijuan Zhang, Xiling Xu, Hong Gao, Weijun Zheng              
                    化学进展 36, 1830 (2024).               Progress in Chemistry 36, 1830 (2024).(in Chinese)   https://doi.org/10.7536/PC241110                
             
192. Structural and bonding properties of Ta2Cn−/0 (n = 1−7) clusters: Size-selected anion photoelectron spectroscopy and theoretical calculations              
     Chaojiang Zhang, Hong-Guang Xu, Xiling Xu, and Weijun Zheng              
                   J. Chem. Phys. 161, 194310 (2024).      https://doi.org/10.1063/5.0233496              
             
191. Dispersion Leading Potential Energy Surface of N2·NbN12-: Anion Photoelectron Spectroscopy and Theoretical Studies                  
     Kai-Wen Liu, Bin Yang, Peng Wang, Shuai-Ting Yan, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng              
                   J. Chem. Phys. 161, 164303 (2024).     https://doi.org/10.1063/5.0232657


190.               Photoelectron Spectroscopy and Theoretical Studies on the Structures and Properties of Ge4C− and Ge4CH− Clusters              
     Li-Juan Zhao, Xi-Ling Xu, Umar Farooq, Wei-Jun Zheng, and Hong-Guang Xu              
                   J. Phys. Chem. A  128, 8964 (2024).      https://doi.org/10.1021/acs.jpca.4c05386              
             
189.               Observation of Halogen-like Behavior of Gold in Fluorinated Bimetallic CoAuF1-2− and CuAuF1-2− Clusters: Anion Photoelectron Spectroscopy and Density Functional Theory              
     Zhen-Chao Long, Aaron Shah, Huta Banjade, Kai-Wen Liu, Hong-Guang Xu, Weijun Zheng, and Puru Jena              
                   J. Chem. Phys. 161, 124304 (2024).      https://doi.org/10.1063/5.0224002               
             
188.               Disentangling the catalytic mechanisms of C60-buffered Cu/SiO2 catalyst for DMO-to-EG conversion              
     Jianzhi Xu, Zhen-Chao Long, Zuo-Chang Chen, Chang-Feng Zhu, Hong-Guang Xu, Jianwei Zheng, Ewald Janssens, Wei-Jun Zheng, Gao-Lei Hou, Su-Yuan Xie              
                   ACS Catal. 14, 14733 (2024).   https://doi.org/10.1021/acscatal.4c03943              
             
187.               Pentacoordinated pyramidal structures and bonding properties of WN10−/0: anion photoelectron spectroscopy and theoretical calculations              
     Kai-Wen Liu, Jia-Le Li, Xi-Ling Xu, Hong-Guang Xu, Ke-Wei Ding and Wei-Jun Zheng              
                   Phys. Chem. Chem. Phys. 26, 21009 (2024).     https://doi.org/10.1039/D4CP02262A 

 

186.               Microsolvation of salts in water: A comprehensive overview of the experimental and computational approaches              
     Umar Farooq, Syed Majid Bukhari, Sara Khan, Xi-Ling Xu, Hong-Guang Xu, Wei-Jun Zheng              
                   Coordination Chem. Rev. 517, 216041 (2024).    https://doi.org/10.1016/j.ccr.2024.216041              
             
185.               Hexagonal Bipyramidal Mn3Ge5 Cluster and Its One-Dimensional Ferrimagnetic Sandwich Nanowire: Mn3Ge3 Rings as Structural Motifs              
     Li-Juan Zhao, Xi-Ling Xu, Umar Farooq, Wei-Jun Zheng, and Hong-Guang Xu              
                   Inorg. Chem. 63, 11252 (2024).   https://doi.org/10.1021/acs.inorgchem.4c01068              
             
184.               Anion Photoelectron Spectroscopy and Quantum Chemical Calculations of LaCu2On−/0 (n=4, 5): Interaction between Oxygen Unit and LaCu2O3 Six-Membered Ring              
     Shuai-Ting Yan, Xi-Ling Xu, Hong-Guang Xu, Wei-Jun Zheng              
                   Chin. J. Chem. Phys. 37, 313 (2024).   https://doi.org/               10.1063/1674-0068/cjcp2308073              
             
183.               Unusually High-Spin Fe12C12– Metallo-Carbohedrene Clusters              
     Lijun Geng, Turbasu Sengupta, Xilong Li, Chaonan Cui, Shiquan Lin, Xi-Ling Xu, Arthur C. Reber, Shiv N. Khanna, Wei-Jun Zheng, and Zhixun Luo              
                   J. Am. Chem. Soc. 145, 26908 (2023).   https://doi.org/10.1021/jacs.3c09690

 

182.                Structures and Properties of Planar Ge3O3 Cluster and Its Buckled Honeycomb Two-Dimensional Nanostructure

        Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, Wei-Jun Zheng

                       Nano Lett. 23, 8378 (2023).                  https://doi.org/10.1021/acs.nanolett.3c02778

 

181.               Anion Photoelectron Spectroscopy and Theoretical Studies of Ge3n+1O (n = 1−3) Clusters with the C3v Symmetric Ge3 Structural Unit              
        Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, Wei-Jun Zheng              
                      Inorg. Chem. 62, 15164 (2023)                  https://doi.org/10.1021/acs.inorgchem.3c02306

 

180.               Polynitrogen Clusters Interaction with Water: Experimental and Theoretical Perspectives              
        Kewei Ding, Peng Wang, Wenli Zhou, Hongguang Xu, Zhongxue Ge, Weijun Zheng, and Cheng Lu              
                      J. Phys. D: Appl. Phys.  56,  455301 (2023).                 https://doi.org/10.1088/1361-6463/acec84

 

179.               The Structural Evolution and Electronic Properties of V2Sin−/0 (n = 7−14) Clusters: Anion Photoelectron Spectroscopy and Theoretical Calculations              
        Lijuan Zhang, Bin Yang, Da-Zhi Li, Ling Pei, Umar Farooq, Xi-Ling Xu, Wei-Jun Zheng, Hong-Guang Xu              
                      Inorg. Chem. 62, 14727 (2023).                 https://doi.org/10.1021/acs.inorgchem.3c02174

 

178.               Reconsidering the Structures of C2Al4- and C2Al5-              
        Chao-Jiang Zhang, Filiberto Ortíz-Chi, Xi-Ling Xu, Hong-Guang Xu, Gabriel Merino, Wei-Jun Zheng              
                      Chem. Eur. J. 29, e202301338 (2023).                 https://doi.org/10.1002/chem.202301338

 

177.                Solvation of magnesium chloride dimer in water: The case of anionic and neutral clusters

        Zhiyou Wei, Hongguang Xu, Xiling Xu, Gang Feng, Weijun Zheng, Tao Li

                        J. Chem. Phys. 158, 174311 (2023).                  https://doi.org/10.1063/5.0146319

 

176.                Structures and Bonding Properties of Lithium Polysulfide Clusters LiSn−/0 (n = 3-5) and Li2S4−/0: Size-Selected Anion Photoelectron Spectroscopy  and Theoretical Calculations

        Zhen-Chao Long, Zhiyou Wei, Kai-Wen Liu, Xi-Long Li, Xi-Ling Xu, Hong-Guang Xu and Weijun Zheng  

                       Phys. Chem. Chem. Phys. 25, 10495 (2023).                   https://doi.org/10.1039/D2CP06061B

 

175.                Identification of Ge≡O Triple Bond in Ge6O− Cluster: Anion Photoelectron Spectroscopy and Theoretical Calculations

        Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                        J. Phys. Chem. Lett. 14, 2854 (2023).                   https://doi.org/10.1021/acs.jpclett.3c00207

 

174.                Anion photoelectron spectroscopy and quantum chemical calculations of bimetallic niobium-aluminum clusters NbAln-/0 (n = 3-12): Identification  of half-encapsulated symmetric structure for NbAl12-

        Shuai-Ting Yan, Zhen-Chao Long, Xi-Ling Xu, Hong-Guang Xu and Weijun Zheng  

                        Phys. Chem. Chem. Phys. 25, 6498 (2023).                 https://doi.org/10.1039/D2CP04978C

 

173.                Investigation of the Structures and Chemical Bonding of Mn2Ge6− and Mn2Ge7− Clusters via Anion Photoelectron Spectroscopy and Theoretical Calculations

        Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                       Inorg. Chem. 62, 2033 (2023).                 https://doi.org/10.1021/acs.inorgchem.2c03612

 

172.               Photoelectron Spectroscopy and Theoretical Studies of Ge6MnO− Cluster with a MnV≡O Unit Interacting with a Double Aromatic Ge64− Ligand

        Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                        Inorg. Chem. 61, 20524 (2022).                  https://doi.org/10.1021/acs.inorgchem.2c03353

 

171.                Photoelectron Spectroscopy and Density Functional Theory Calculations of Binary VnC30/– (n = 1–6) Clusters

       Jinyun Yuan, Peng Wang, Xiling Xu, Yonghui Zhang, Linghao He, Hong-Guang Xu, Gao-Lei Hou, Weijun Zheng

                       Chin. J. Chem. Phys. 35, 907 (2022).                 http://doi.org/10.1063/1674-0068/cjcp2112282

 

170.                Anion Photoelectron Spectroscopy and Quantum Chemical Calculations of Bimetallic Oxide Clusters YCu2On−/0 (n = 2-5)

       Shuai-Ting Yan, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng

                      J. Phys. Chem. A                  126, 6067 (2022).                   https://doi.org/10.1021/acs.jpca.2c03968   

 

169.                Structural Evolution of Carbon-Doped Aluminum Clusters AlnC− (n = 6−15): Anion Photoelectron Spectroscopy and Theoretical Calculations

       Chao-Jiang Zhang, Wen-Shuai Dai, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                       J. Phys. Chem. A 126, 5621 (2022).                   https://doi.org/10.1021/acs.jpca.2c04754  

 

168.                Identification of Ge=O Double Bonds in Planar MnGe3O and MnGe4O Clusters: Anion Photoelectron Spectroscopy and ab initio Calculations

       Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                       Inorg. Chem. 61, 12570 (2022).                   https://doi.org/10.1021/acs.inorgchem.2c01466  

 

167.                Investigation of highly ferromagnetic Mn2Ge4 and Mn2Ge5 clusters via photoelectron spectroscopy and theoretical calculations

       Li-Juan Zhao, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                       Phys. Chem. Chem. Phys. 24, 18627 (2022).                   https://doi.org/10.1039/D2CP01637K                   

 

166.                Signature of Au as a Halogen

       Aaron Shah, Huta Banjade, Zhen-Chao Long, Zhao-Ou Gao, Hong-Guang Xu, Weijun Zheng, and Puru Jena

                       J. Phys. Chem. Lett. 13, 4721 (2022).                   https://doi.org/10.1021/acs.jpclett.2c00910   

 

165.                Structural Evolution and Bonding Properties of Cr2Sin− (n = 1-12) Clusters: Mass-Selected Anion Photoelectron Spectroscopy and Theoretical Calculations

       Bin Yang, Xi-Ling Xu, Wei-Jun Zheng, and Hong-Guang Xu

                       J. Phys. Chem. A 126, 1182 (2022).                   https://doi.org/10.1021/acs.jpca.1c10810

 

164.                Anion photoelectron spectroscopy and density functional theory studies of AuCn−/0 (n=3−8): Odd-even alternation in electron binding energies and structures

       Peng Wang, Shuai-Ting Yan, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng

                       Chin. J. Chem. Phys. 35, 177 (2022).                   https://doi.org/10.1063/1674-0068/cjcp2112267   

 

163.                Anion photoelectron spectroscopy and theoretical calculations of Cu4On−/0 (n = 1–4): Identification of stable quasi-square structure for Cu4O4−

       Shuai-Ting Yan,  Hong-Guang Xu,  Xi-Ling Xu, and  Wei-Jun Zheng

                       J. Chem. Phys. 156, 054304 (2022).                   https://doi.org/10.1063/5.0078415                   

 

162.               Structural and Electronic Properties of LaSin−/0 (n = 2−6) Clusters: Anion Photoelectron Spectroscopy and Density Functional Calculations              
        Wen-Shuai Dai, Bin Yang, Shuai-Ting Yan, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       J. Phys. Chem. A 125, 10557 (2021).                 https://doi.org/10.1021/acs.jpca.1c08487                 
             
161.               Structural and Bonding Properties of AlnC4-/0 (n=2-4) Clusters: Anion Photoelectron Spectroscopy and Theoretical Calculations              
        Chao-jiang Zhang, Shuai-ting Yan, Hong-guang Xu, Xi-ling Xu, Wei-jun Zheng              
                       Chin. J. Chem. Phys. 34, 769 (2021).                https://doi.org/10.1063/1674-0068/cjcp2110185                 
             
160.               Observation of Aromatic Three-Membered Rings in Ge3C and Ge3O via Photoelectron Spectroscopy and Theoretical Calculations              
        Li-Juan Zhao, Shuai-Ting Yan, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       Inorg. Chem. 60, 16645 (2021).                 https://doi.org/10.1021/acs.inorgchem.1c02540                 
             
159.               Structures and hydrogen bonding of 1,7-dioxaspiro[5.5]undecane and its hydrates              
        Yugao Xu, Zhi-You Wei, Wenqin Li, Jiaqi Zhang, Tao Lu, Yan Jin, Wei-Jun Zheng and Gang Feng              
                       Phys. Chem. Chem. Phys. 23, 19289 (2021).                 https://doi.org/10.1039/d1cp02964a                 
             
158.               Identification of octahedral coordinated ZrN12+ cationic clusters by mass spectrometry and structure searches              
        Kewei Ding, Hujie Chen, Hongguang Xu, Bin Yang, Zhongxue Ge, Cheng Lu, and Weijun Zheng              
                       Dalton Transactions 50, 10187 (2021).                 https://doi.org/10.1039/D1DT01018B   

 

157.               A joint experimental and theoretical study on structural, electronic, and magnetic properties of MnGen− (n = 3–14) clusters              
        Yi-Wei Fan, Xiang-Yu Kong, Li-Juan Zhao, Huai-Qian Wang, Hui-Fang Li, Qian Zhan, Biao Xie, Hong-Guang Xu, and Wei-Jun Zheng              
                       J. Chem. Phys. 154, 204302 (2021).                https://doi.org/10.1063/5.0053414   


156.               Structures of (NaSCN)2(H2O)n−/0 (n = 0–7) and solvation induced ion pair separation: Gas phase anion photoelectron spectroscopy and theoretical calculations              
        Shi-Yan Gong, Peng Wang, Zhi-You Wei, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       J. Chem. Phys. 154, 204301 (2021).                https://doi.org/10.1063/5.0049567   


155.               Comparison of the Microsolvation of CaX2 (X = F, Cl, Br, I) in Water: Size-Selected Anion Photoelectron Spectroscopy and Theoretical Calculations              
        Zhi-You Wei, Li-Jiang Yang, Shi-Yan Gong, Hong-Guang Xu, Xi-Ling Xu, Yi Qin Gao, and Wei-Jun Zheng              
                       J. Phys. Chem. A 125, 3288 (2021).                https://doi.org/10.1021/acs.jpca.1c00573   


154.               Photoelectron Spectroscopy and Theoretical Study of AlnC5-/0 (n = 1-5) clusters: Structural Evolution, Relative Stability of Star-Like Cluster, and Planar Tetracoordinate Carbon Structure        

        Chao-Jiang Zhang, Peng Wang, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng               
                       Phys. Chem. Chem. Phys. 23, 1967 (2021).                https://doi.org/10.1039/D0CP06081J    


153.               Electronic structures, chemical bonds, and stabilities of Ta4Cn-/0 (n = 0–4) clusters: Anion photoelectron spectroscopy and theoretical calculations              
        Chao-Jiang Zhang, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       Acta Phys. Sin. 70, 023601 (2021).(in Chinese)   doi:               10.7498/aps.70.20201351               
             
152.               Anion Photoelectron Spectroscopy and Theoretical Studies of Al4C6–/0: Global Minimum Triangle-Shaped Structures and Hexacoordinated Aluminum              
        Chao-Jiang Zhang, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       J. Phys. Chem. A 125, 302 (2021).                https://doi.org/10.1021/acs.jpca.0c10048   

 

151.               Structural Evolution and Electronic Properties of TaSin-/0 (n = 2−15) Clusters: Size-Selected Anion Photoelectron Spectroscopy and Theoretical Calculations              
        Sheng-Jie Lu, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       J. Phys. Chem. A 124, 9818 (2020).                https://doi.org/10.1021/acs.jpca.0c09209  


150.               Hydration processes of barium chloride: Size-selected anion photoelectron spectroscopy and theoretical calculations of BaCl2-water clusters              
        Zhiyou Wei, Lijiang Yang, Hong-Guang Xu, Umar Farooq, Xiling Xu, Yi Qin Gao, and Weijun Zheng              
                       J. Chem. Phys. 153, 134301 (2020).                https://doi.org/10.1063/5.0021991   


149.               Photoassisted Selective Steam and Dry Reforming of Methane to Syngas Catalyzed by Rhodium–Vanadium Bimetallic Oxide Cluster Anions at Room Temperature

        Yan-Xia Zhao, Bin Yang, Hai-Fang Li, Yan Zhang, Yuan Yang, Qing-Yu Liu, Hong-Guang Xu, Wei-Jun Zheng, and Sheng-Gui He              
                       Angew. Chem. Int. Ed. 59, 2 (2020).                https://doi.org/10.1002/anie.202010026   

 

148.               Appearance of V-encapsulated tetragonal prism motifs in VSi10¯ and VSi11¯ clusters

        Lijuan Zhang, Bin Yang, Dazhi Li, Umar Farooq, Xi-Ling Xu, Weijun Zheng, Hong-Guang Xu              
                       Phys. Chem. Chem. Phys. 22, 22989 (2020).                https://doi.org/10.1039/D0CP04101G                
             
147.               Microsolvation of Sodium Thiocyanate in Water: Gas Phase Anion Photoelectron Spectroscopy and Theoretical Calculations

        Shiyan Gong, Peng Wang, Zhiyou Wei, Bin Yang, Xiling Xu, Hongguang Xu, and Weijun Zheng              
                       J. Phys. Chem. A 124, 7816 (2020).                  https://doi.org/10.1021/acs.jpca.0c07071   


146.               Mass spectrometry detection of LiN12+ cluster and theoretical investigation of its structures and stability

        Kewei Ding, Taoqi Li, Hongguang Xu, Yisu Li, Zhongxue Ge, Weiliang Zhu, and Weijun Zheng              
                       Chem. Phys. Lett. 747, 137310 (2020).                 https://doi.org/10.1016/j.cplett.2020.137310                
             
145.               Recent progress in theoretical and experimental studies of metal-doped silicon clusters: Trend among elements of periodic table

        Umar Farooq, Sadia Naz, Hong-Guang Xu, Bin Yang, Xi-Ling Xu, Wei-Jun Zheng              
                       Coordination Chem. Rev. 403, 213095 (2020).                 https://doi.org/10.1016/j.ccr.2019.213095                
             
144.               Structures and bonding properties of CPt2-/0 and CPt2H-/0: anion photoelectron spectroscopy and quantum chemical calculations

        Sheng-Jie Lu, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng              
                       J. Chem. Phys. 151, 224303 (2019).                 https://doi.org/10.1063/1.5130589                
             
143.               Direct Conversion of Methane with Carbon Dioxide Mediated by RhVO3− Cluster Anions

        Yuan Yang, Bin Yang, Yan-Xia Zhao, Li-Xue Jiang, Hong-Guang Xu, Wei-Jun Zheng, and Sheng-Gui He              
                       Angew. Chem. Int. Ed. 58, 17287 (2019).                 https://doi.org/10.1002/anie.201911195   


142.               Structural Evolution and Electronic Properties of Au2Gen               −               /0 (n = 1−8) Clusters: Anion Photoelectron Spectroscopy and Theoretical Calculations

        Sheng-Jie Lu, Umar Farooq, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       Chin. J. Chem. Phys. 32, 229 (2019).                 https://doi.org/10.1063/1674-0068/cjcp1902036                
             
141.               Structural Evolution and Electronic Properties of CoSin− (n = 3-12) Clusters: Mass-Selected Anion Photoelectron Spectroscopy and Quantum Chemistry Calculations

        Bin Yang, Xi-Ling Xu, Hong-Guang Xu, Umar Farooq, Wei-Jun Zheng              
                       Phys. Chem. Chem. Phys. 21, 6207 (2019).                 https://doi.org/10.1039/C8CP07734G                
             
140.               Structural Evolution of LiNn+ (n=2, 4, 6, 8, and 10) Clusters: Mass Spectrometry and Theoretical Calculations

        Zhongxue Ge, Kewei Ding, Yisu Li, Hongguang Xu, Zhaoqiang Chen, Yiding Ma, Taoqi Li, Weiliang Zhu, and Weijun Zheng              
                                    RSC Adv. 9, 6762 (2019).                 https://doi.org/10.1039/C9RA00439D                
             
139.               Size-selected anion photoelectron spectroscopy and density functional theory study of MnCn−/0 (n = 3-10): odd-even alternation and linear-cyclic structure competition

        Xi-Ling Xu, Bin Yang, Chao-Jiang Zhang, Hong-Guang Xu, Wei-Jun Zheng               
                       J. Chem. Phys. 150, 074304 (2019).                 https://doi.org/10.1063/1.5084310                
             
138.               Geometric Structures and Electronic Properties of AlnV0/- (n = 5-14) Clusters: Photoelectron Spectroscopy and Theoretical Calculations

        Xinxin Xia, Zeng-Guang Zhang, Hong-Guang Xu, Xi-ling Xu, Xiaoyu Kuang, Cheng Lu, and Wei-Jun Zheng              
                       J. Phys. Chem. C 123, 1931 (2019).                 https://doi.org/10.1021/acs.jpcc.8b09010                
             
137.               Photoelectron Spectroscopy and Theoretical Study of CrnSi15-nˉ(n = 1-3): Effects of Doping Cr Atoms on the Structural and Magnetic Properties

        Bin Yang, Hongguang Xu, Xiling Xu, Weijun Zheng              
                       J. Phys. Chem. A  122, 9886 (2018).                 https://doi.org/10.1021/acs.jpca.8b10588                
             
136.               Structural evolution and bonding properties of BSinˉ/0 (n = 4−12) clusters: size-selected anion photoelectron spectroscopy and theoretical calculations

        Sheng-Jie Lu, Xiling Xu, Guo-Jin Cao, Hong-Guang Xu, and Weijun Zheng              
                       J. Chem. Phys. 149, 174314 (2018).                 https://doi.org/10.1063/1.5052559                
             
135.               Structural and Bonding Properties of BS−/0 and BS3−/0

        Li-Juan Zhao, Xi-Ling Xu, Hong-Guang Xu, Gang Feng, Wei-Jun Zheng              
                       New J. Chem. 42, 16021 (2018).                 https://doi.org/10.1039/C8NJ01835A                
             
134.               Structural and bonding properties of Cu3O3− and Cu3O4− clusters: anion photoelectron spectroscopy and density functional calculations

        Xi-Ling Xu, Bin Yang, Zhiyou Wei, Guo-Jin Cao, Hong-Guang Xu, and Weijun Zheng              
                       Phys. Chem. Chem. Phys. 20, 20622 (2018).                 https://doi.org/10.1039/C8CP03302A                
             
133.               Structural Evolution and Magnetic Properties of Anionic Clusters Cr2Gen(n = 3-14): Photoelectron Spectroscopy and Density Functional Theory Computation

        Xiaoqing Liang, Xiangyu Kong, Sheng-Jie Lu, Yingying Huang, Jijun Zhao, Hong-Guang Xu, Weijun Zheng, Xiao Cheng Zeng              
                       J. Phys.: Condens. Matter 30, 335501 (2018).                 https://doi.org/10.1088/1361-648X/aad2bf                
             
132.               Structural evolution and bonding properties of Au2Sin-/0 (n = 1−7) clusters: anion photoelectron spectroscopy and theoretical calculations

        Sheng-Jie Lu, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng              
                       J. Chem. Phys.               148, 244306 (2018)               .                 https://doi.org/10.1063/1.5029870   


131.               Molecular dynamics simulation, ab initio calculation and size-selected anion photoelectron spectroscopy study of initial hydration processes of calcium chloride

        Zhili He, Gang Feng, Bin Yang, Lijiang Yang, Cheng-Wen Liu, Hong-Guang Xu, Xi-Ling Xu, Wei-Jun Zheng, and Yi Qin Gao              
                       J. Chem. Phys.               148, 222839 (2018)               .                 https://doi.org/10.1063/1.5024279   


130.               Mass Spectrometry and Theoretical Investigation of VNn+ (n=8, 9, 10) Clusters

        Kewei Ding, Hong-Guang Xu, Yang Yang, Taoqi Li, Zhaoqiang Chen, Zhongxue Ge, Weiliang Zhu, and Wei-Jun Zheng              
                       J. Phys. Chem. A  122, 4687 (2018).                 https://doi.org/10.1021/acs.jpca.7b12152                
             
129.               Spin-Orbit Splittings and Low-Lying Electronic States of AuSi and AuGe: Anion Photoelectron Spectroscopy and ab initio Calculations

        Quoc Tri Tran, Sheng-Jie Lu, Li-Juan Zhao, Xi-Ling Xu, Hong-Guang Xu, Van Tan Tran, Jun Li, and Wei-Jun Zheng              
                      J. Phys. Chem. A 122, 3374 (2018).                 https://doi.org/10.1021/acs.jpca.8b01366                
             
128.               Catalytic CO Oxidation by O2 Mediated by Noble-Metal-Free Cluster Anions Cu2VO3-5-

        Li-Na Wang,Xiao-Na Li, Li-Xue Jiang,Bin Yang,Qing-YuLiu, Hong-Guang Xu, Wei-Jun Zheng, and Sheng-Gui He              
                       Angew. Chem. Int. Ed. 57, 3349 (2018).                 https://doi.org/10.1002/anie.201712129                
             
127.               A photoelectron spectroscopy and quantum chemical study on ternary Al-B-O clusters: AlnBO2− and AlnBO2 (n = 2, 3)

        Ting Ou, Yuan Feng, Wen-Juan Tian, Li-Juan Zhao, Xiang-Yu Kong, Hong-Guang Xu, Wei-Jun Zheng, and Hua-Jin Zhai              
                       Phys. Chem. Chem. Phys. 20, 5200 (2018).                 https://doi.org/10.1039/C7CP08512E                
             
126.               Structural Evolution of B2Sin–/0 (n = 3–12) Clusters: Size-Selected Anion Photoelectron Spectroscopy and Theoretical Calculations

        Sheng-Jie Lu, Xi-Ling Xu, Guo-Jin Cao, Hong-Guang Xu, and Wei-Jun Zheng

                       J. Phys. Chem. C  122, 2391 (2018).                 https://doi.org/10.1021/acs.jpcc.7b10906                
             
125.               Structural and electronic properties of ConC3−/0 and ConC4−/0 (n = 1−4) clusters: mass-selected anion photoelectron spectroscopy and density functional theory calculations

        Xi-Ling Xu, Jin-Yun Yuan, Bin Yang, Hong-Guang Xu, Wei-Jun Zheng              
                       Chin. J. Chem. Phys. 30, 717 (2017).                 https://doi.org/10.1063/1674-0068/30/cjcp1710197                
             
124.               Structural and Magnetic Properties of FeGen-/0 (n = 3-12) Clusters: Mass-Selected Anion Photoelectron Spectroscopy and Density Functional Theory Calculations

        Xiao-Jiao Deng, Xiang-Yu Kong, Xiaoqing Liang, Bin Yang, Hong-Guang Xu, Xi-Ling Xu, Gang Feng, Wei-Jun Zheng              
                       J. Chem. Phys. 147, 234310 (2017).                 https://doi.org/10.1063/1.5000886                
             
123.               Nonconventional Hydrogen Bonds between Silver Anion and Nucleobases: Size-Selected Anion Photoelectron Spectroscopy and Density Functional Calculations

        Peng Wang, Hong-Guang Xu, Guo-Jin Cao, Wen-Jing Zhang, Xi-Ling Xu, and Wei-Jun Zheng              
                      J. Phys. Chem. A 121, 8973 (2017).                 https://doi.org/10.1021/acs.jpca.7b09428                
             
122.               Interaction of FeO- with water: anion photoelectron spectroscopy and theoretical calculations

        Li-Juan Zhao, Xi-Ling Xu, Hong-Guang Xu, Gang Feng, and Wei-Jun Zheng              
                       Phys. Chem. Chem. Phys. 19, 21112 (2017).                 https://doi.org/10.1039/C7CP03870D                
             
121.               Initial hydration processes of magnesium chloride: size-selected anion photoelectron spectroscopy and ab initio calculations

        Gang Feng, Cheng-Wen Liu, Zhen Zeng, Gao-Lei Hou, Hong-Guang Xu, and Wei-Jun Zheng              
                       Phys. Chem. Chem. Phys. 19, 15562 (2017).                 https://doi.org/10.1039/C7CP02965A               
             
120.               Anion Photoelectron Spectroscopy and Theoretical Investigation on Nb2Sin–/0 (n = 2–12) Clusters

        Sheng-Jie Lu, Hong-Guang Xu, Xi-Ling Xu, and Wei-Jun Zheng              
                       J. Phys. Chem. C  121, 11851 (2017).                 https://doi.org/10.1021/acs.jpcc.7b01904                
             
119.               Gas phase anion photoelectron spectroscopy and theoretical investigation of gold acetylide species

        Peng Wang, Wenjing Zhang, Xi-Ling Xu, Jinyun Yuan, Hong-Guang Xu, and Weijun Zheng              
                       J. Chem. Phys. 146, 194303 (2017).                 https://doi.org/10.1063/1.4983304                
             
118.               Probing Structural, Electronic, and Magnetic Properties of Iron-Doped Semiconductor Clusters Fe2Gen–/0 (n = 3–12) via Joint Photoelectron Spectroscopy and Density Functional Study

        Xiao-Qing Liang, Xiao-Jiao Deng, Sheng-Jie Lu, Xiao-Ming Huang, Ji-Jun Zhao, Hong-Guang Xu, Wei-Jun Zheng, and Xiao Cheng Zeng              
                       J. Phys. Chem. C 121, 7037 (2017).                               https://doi.org/10.1021/acs.jpcc.7b00943   


117.               Structures and electronic properties of B3Sin- (n = 4-10) clusters: A combined ab initio and experimental study

        Xue Wu, Sheng-Jie Lu, Xiaoqing Liang, Xiaoming Huang, Ying Qin, Maodu Chen, Jijun Zhao, Hong-Guang Xu, R.Bruce King, Weijun Zheng              
                      J. Chem. Phys.               146               , 044306                (2017)               .                 https://doi.org/10.1063/1.4974337   


116.               Emergence of Solvent-Separated Na+-Cl‒ Ion Pair in Salt Water: Photoelectron Spectroscopy and Theoretical Calculations

        Gao-Lei Hou, Cheng-Wen Liu, Ren-Zhong Li, Hong-Guang Xu, Yi Qin Gao, Wei-Jun Zheng              
                      J. Phys. Chem. Lett. 8, 13 (2017).                 https://doi.org/10.1021/acs.jpclett.6b02670                
             
115.               The structural and electronic properties of NbSin−/0 (n = 3–12) clusters: anion photoelectron spectroscopy and ab initio calculations

        Sheng-Jie Lu, Guo-Jin Cao, Xi-Ling Xu, Hong-Guang Xu and Wei-Jun Zheng              
                       Nanoscale 8, 19769 (2016).                 https://doi.org/10.1039/C6NR07480D                
             
114.               Hydration of potassium iodide dimer studied by photoelectron spectroscopy and ab initio calculations

        Ren-Zhong Li, Zhen Zeng, Gao-Lei Hou, Hong-Guang Xu, Xiang Zhao, Yi Qin Gao, and Wei-Jun Zheng              
                       J. Chem. Phys.               145               , 184307                (2016)               .                 https://doi.org/10.1063/1.4967168  


113.               Structural and Electronic Properties of AuSin− (n = 4−12) Clusters: Photoelectron Spectroscopy and Ab Initio Calculations

        Sheng-Jie Lu, Xi-Ling Xu, Gang Feng, Hong-Guang Xu, and Wei-Jun Zheng              
                                     J. Phys. Chem. C 120, 25628 (2016).                 https://doi.org/10.1021/acs.jpcc.6b08598                
             
112.               Structural and Electronic Properties of HCnS− (n = 4–11): Anion Photoelectron Spectroscopy and Density Functional Calculations

        Xi-Ling Xu, Bin Yang, Hong-Guang Xu, Xiao-Jiao Deng, and Wei-Jun Zheng              
                                     RSC Adv. 6, 78064 (2016).                 https://doi.org/10.1039/C6RA13665F                
             
111.               Photodissociation and density functional calculations of A2M+ and G2M+ (A = adenine, G = guanine, M = Cu, Ag or Au) cluster ions

       Guo-Jin Cao, Hong-Guang Xu, Xi-Ling Xu, Peng Wang, and Wei-Jun Zheng              
                       Int. J. Mass. Spectrom. 407, 118 (2016).                 https://doi.org/10.1016/j.ijms.2016.07.008                
             
110.               Probing the structural evolution of ruthenium doped germanium clusters: Photoelectron spectroscopy and density functional theory calculations

        Yuan-Yuan Jin, Sheng-Jie Lu, Andreas Hermann, Xiao-Yu Kuang, Chuan-Zhao Zhang, Cheng Lu, Hong-Guang Xu and Wei-Jun Zheng              
                       Sci. Rep. 6, 30116 (2016).                 https://doi.org/10.1038/srep30116                
             
109.               Structures and Electronic Properties of B2Si6-/0/+: Anion Photoelectron Spectroscopy and Theoretical Calculations

       Guo-Jin Cao, Sheng-Jie Lu, Hong-Guang Xu, Xi-Ling Xu, Wei-Jun Zheng              
                                    RSC Adv. 6, 62165 (2016).                 https://doi.org/10.1039/C6RA08251C                
             
108.               Transition from exohedral to endohedral structures of AuGen− (n = 2–12) clusters: photoelectron spectroscopy and ab initio calculations

        Sheng-Jie Lu, Lian-Rui Hu, Xi-Ling Xu, Hong-Guang Xu, Hui Chen, and Wei-Jun Zheng              
                       Phys. Chem. Chem. Phys. 18, 20321 (2016).                 https://doi.org/10.1039/C6CP00373G                
             
107.               Structures and chemical bonding of B3O3-/0 and B3O3H-/0: A combined photoelectron spectroscopy and first-principles theory study

        Li-Juan Zhao, Wen-Juan Tian, Ting Ou, Hong-Guang Xu, Gang Feng, Xi-Ling Xu, Hua-Jin Zhai, Si-Dian Li, and Wei-Jun Zheng              
                       J. Chem. Phys.               144               , 124301                (2016)               .                 https://doi.org/10.1063/1.4943768  


106.               Structural Evolution and Electronic Properties of VnC2 and VnC4 (n = 1–6) Clusters: Insights from Photoelectron Spectroscopy and Theoretical Calculations

        Jinyun Yuan, Peng Wang, Gao-Lei Hou, Gang Feng, Wen-Jing Zhang, Xi-Ling Xu, Hong-Guang Xu, Jinlong Yang, and Wei-Jun Zheng              
                      J. Phys. Chem. A 120, 1520 (2016).                 https://doi.org/10.1021/acs.jpca.6b00241                
             
105.               Superhalogen Properties of BS2− and BSO−: Photoelectron Spectroscopy and Theoretical Calculations

        Li-Juan Zhao, Hong-Guang Xu, Gang Feng, Peng Wang, Xi-Ling Xu, Wei-Jun Zheng              
                      Phys. Chem. Chem. Phys. 18, 6175 (2016).                 https://doi.org/10.1039/C5CP07673K               
             
104.               Photoelectron Spectroscopy and Density Functional Calculations of TiGen- (n=7-12) Clusters

        Xiao-Jiao Deng, Xiang-Yu Kong, Xi-Ling Xu, Hong-Guang Xu, Wei-Jun Zheng              
                      Chin. J. Chem. Phys. 29, 123 (2016).                 https://doi.org/10.1063/1674-0068/29/cjcp1511232                
             
103.               Initial Hydration Behavior of Sodium iodide dimer: Photoelectron spectroscopy and ab initio calculations

        Ren-Zhong Li, Gao-Lei Hou, Cheng-Wen Liu, Hong-Guang Xu, Xiang Zhao, Yi Qin Gao, Wei-Jun Zheng              
                       Phys. Chem. Chem. Phys. 18, 557 (2016).                 https://doi.org/10.1039/C5CP05550D                
             
102.               Photoelectron Spectroscopy and Density Functional Calculations of CnSm- (n = 2-7; m = 1, 2) clusters

        Xi-Ling Xu, Xiao-Jiao Deng, Hong-Guang Xu and Wei-Jun Zheng              
                       Phys. Chem. Chem. Phys. 17, 31011 (2015).                 https://doi.org/10.1039/C5CP04482K                
             
101.               Structures and Electronic Properties of (KI)n–/0 (n = 1–4) and K(KI)n–/0 (n = 1–3) Clusters: Photoelectron Spectroscopy, Isomer-Depletion, and ab Initio Calculations

        Gao-Lei Hou, Gang Feng, Li-Juan Zhao, Hong-Guang Xu, and Wei-Jun Zheng              
                      J. Phys. Chem. A 119, 11154 (2015).                 https://doi.org/10.1021/acs.jpca.5b09205                
             
100.               Microsolvation of sodium acetate in water: Anion photoelectron spectroscopy and ab initio calculations

        Wen-Jing Zhang, Gao-Lei Hou, Peng Wang, Hong-Guang Xu, Gang Feng, Xiling Xu, and Weijun Zheng              
                        J. Chem. Phys. 143, 054302 (2015).                 https://doi.org/10.1063/1.4927668                
             
99.                Photoelectron spectra and structure of the Mnn- anions (n = 2-16)

       G. L. Gutsev, C. A. Weatherford, B. R. Ramachandran, L. G. Gutsev, W.-J. Zheng, O. C. Thomas, and Kit H. Bowen              
                      J. Chem. Phys.               143               , 044306               (2015)               .  https://doi.org/10.1063/1.4926943                
             
98.                Experimental Observation of TiN12+ Cluster and Theoretical Investigation of Its Stable and Metastable Isomers

       Ke-Wei Ding, Xiao-Wei Li, Hong-Guang Xu, Tao-Qi Li, Zhong-Xue Ge, Qian Wang, and Wei-Jun Zheng              
                      Chem. Sci. 6, 4723 (2015).                 https://doi.org/10.1039/C5SC01103E                
             
97.                Photoelectron spectroscopy of B4O4-: Dual 3c-4e pi hyperbonds and rhombic 4c-4e o-bond in boron oxide clusters

       Wen-Juan Tian, Li-Juan Zhao, Qiang Chen, Ting Ou, Hong-Guang Xu, Wei-Jun Zheng, Hua-Jin Zhai, and Si-Dian Li              
                      J. Chem. Phys. 142, 134305 (2015).                 https://doi.org/10.1063/1.4916386                
             
96.                Structures and electronic properties of V3Sin− (n = 3-14) clusters: a combined ab initio and experimental study

       Xiaoming Huang, Sheng-Jie Lu, Xiaoqing Liang, Yan Su, Linwei Sai, Zeng-Guang Zhang, Jijun Zhao, Hong-Guang Xu, Weijun Zheng              
                      J. Phys. Chem. C 119, 10987 (2015).                 https://doi.org/10.1021/jp5112845                
             
95.                Photoelectron Spectroscopy and Density Functional Calculations of VGen- (n = 3-12) Clusters

       Xiao-Jiao Deng, Xiang-Yu Kong, Hong-Guang Xu, Xi-Ling Xu, Gang Feng, Wei-Jun Zheng              
                      J. Phys. Chem. C 119, 11048 (2015).                 https://doi.org/10.1021/jp511694c                
             
94.                Microsolvation of LiBO2 in Water: Anion Photoelectron Spectroscopy and ab initio Calculations

       Zhen Zeng, Gao-Lei Hou, Jian Song, Gang Feng, Hong-Guang Xu, Wei-Jun Zheng              
                      Phys. Chem. Chem. Phys. 17, 9135 (2015).                 https://doi.org/10.1039/C5CP00020C                
             
93.                Photoelectron Spectroscopy and ab initio Calculations of Li(H2O)n– and Cs(H2O)n– (n = 1-6) Clusters

       Zhen Zeng, Cheng-Wen Liu, Gao-Lei Hou, Gang Feng, Hong-Guang Xu, Yi Qin Gao, Wei-Jun Zheng              
                      J. Phys. Chem. A 119, 2845 (2015).                 https://doi.org/10.1021/jp512177j               
             
92.                On the Dissolution of Lithium Sulfate in Water: Anion Photoelectron Spectroscopy and Density Functional Theory Calculations

       Gang Feng, Gao-Lei Hou, Hong-Guang Xu, Zhen Zeng, and Wei-Jun Zheng              
                      Phys. Chem. Chem. Phys. 17, 5624 (2015).                 https://doi.org/10.1039/C4CP05698A               
             
91.                Identification of Hyperhalogens in Agn(BO2)m (n=1-3, m=1-2) clusters: Anion Photoelectron Spectroscopy and Density Functional Calculations

       Xiang-Yu Kong, Hong-Guang Xu, Pratik Koirala, Wei-Jun Zheng, Anil K. Kandalam, and Puru Jena              
                     Phys. Chem. Chem. Phys. 16, 26067 (2014).                 https://doi.org/10.1039/C4CP04299A                
             
90.                Discovery of a Silicon-based Ferrimagnetic Wheel Structure in VxSi12-(x=1-3) Clusters: Photoelectron Spectroscopy and Density Functional Theory Investigation

       Xiaoming Huang, Hong-Guang Xu, Sheng-Jie Lu, Yan Su, R. B. King, Jijun Zhao, and Weijun Zheng              
                      Nanoscale  6, 14617 (2014).                 https://doi.org/10.1039/C4NR03130J                
             
89.               Structural and Magnetic Properties of CoGen- (n = 2-11) Clusters: Photoelectron Spectroscopy and Density Functional Calculations

      Xiao-Jiao Deng, Xiang-Yu Kong, Xi-Ling Xu, Hong-Guang Xu, Wei-Jun Zheng              
                     ChemPhysChem 15, 3987 (2014).                 https://doi.org/10.1002/cphc.201402615                
             
88.               Photoelectron Spectroscopy and Density Functional Theory Study of Bi2Aln− (n=1-4) Clusters

      Zhang Sun, Hong-Guang Xu, Gang Feng, Xi-Ling Xu, Wei-Jun Zheng              
                   Chem. Phys. Lett. 615, 56 (2014).                 https://doi.org/10.1016/j.cplett.2014.09.049                
             
87.               Photoelectron spectroscopy and ab initio calculations of small SinSm- (n = 1,2; m = 1-4) clusters

      Xi-Ling Xu, Xiao-Jiao Deng, Hong-Guang Xu, and Wei-Jun Zheng              
                    J. Chem. Phys. 141, 124310 (2014).                 https://doi.org/10.1063/1.4896384                
             
86.               Photoelectron Spectroscopy of CoC2H2- and Density Functional Study of ConC2H2 (n = 1−3) Anion and Neutral Clusters

      Jinyun Yuan, Gao-Lei Hou, Baocheng Yang, Hong-Guang Xu, and Weijun Zheng              
                     J. Phys. Chem. A 118, 6757 (2014).                 https://doi.org/10.1021/jp504933a                
             
85.               Adsorption of water molecules on sodium chloride trimer

      Cheng-Wen Liu, Gao-Lei Hou, Wei-Jun Zheng, Yi Qin Gao              
                     Theor. Chem. Acc. 133, 1550 (2014).                 https://doi.org/10.1007/s00214-014-1550-1                
             
84.               Vibrationally Resolved Photoelectron Spectroscopy of the Model GFP Chromophore Anion Revealing the Photoexcited S1 State Being Both Vertically and Adiabatically Bound against the Photodetached D0 Continuum

      S. H. M. Deng, Xiang-Yu Kong, GuanXin Zhang, Yan Yang, Wei-Jun Zheng, Zhen-Rong Sun, De-Qing Zhang, and Xue-Bin Wang              
                     J. Phys. Chem. Lett. 5, 2155 (2014).                 https://doi.org/10.1021/jz500869b                
             
83.               Structural and bonding properties of small TiGen (n=2-6) clusters: photoelectron spectroscopy and density functional calculations

      Xiao-Jiao Deng, Xiang-Yu Kong, Xi-Ling Xu, Hong-Guang Xu, and Wei-Jun Zheng              
                     RSC Adv. 4, 25963 (2014).                 https://doi.org/10.1039/C4RA02897J                
             
82.               Photoelectron spectroscopy and density functional study of ConOH- (n = 1-3)

      Ren-Zhong Li, Hong-Guang Xu, Xi-Ling Xu, Wei-Jun Zheng              
                     Chem. Phys. Lett. 607, 105 (2014).                 https://doi.org/10.1016/j.cplett.2014.05.051               
             
81.               Thermal Methane Activation by La6O10- Cluster Anions

      Jing-Heng Meng, Xiao-Jiao Deng, Zi-Yu Li, Sheng-Gui He, and Wei-Jun Zheng              
                     Chem. Eur. J. 20, 5580 (2014).                 https://doi.org/10.1002/chem.201400218                
             
80.               Photoelectron spectroscopy of lithium and gold alloyed boron oxide clusters: charge transfer complexes, covalent gold, hyperhalogen, and dual three-center four-electron hyperbonds

      Wen-Juan Tian, Hong-Guang Xu, Xiang-Yu Kong, Qiang Chen, Weijun Zheng, Hua-Jin Zhai and Sidian Li              
                     Phys. Chem. Chem. Phys. 16, 5129 (2014).                 https://doi.org/10.1039/C3CP55362K                
             
79.               Photoelectron Spectroscopy and Density Functional Study of ConC2- (n=1-5) Clusters

      Jin-Yun Yuan, Hong-Guang Xu and Wei-Jun Zheng               
                     Phys. Chem. Chem. Phys. 16, 5434 (2014).                 https://doi.org/10.1039/C3CP54758B                
             
78.               Theoretical and experimental studies of the interactions between Au2− and nucleobases

      Guo-Jin Cao, Hong-Guang Xu, Wei-Jun Zheng and Jun Li                
                     Phys. Chem. Chem. Phys. 16, 2928 (2014).                 https://doi.org/10.1039/C3CP54478H                
             
77.               Stable Salt−Water Cluster Structures Reflect the Delicate Competition between Ion−Water and Water−Water Interactions

      Cheng-Wen Liu, Feng Wang, Lijiang Yang, Xin-Zheng Li, Wei-Jun Zheng, and Yi Qin Gao              
                     J. Phys. Chem. B 118, 743 (2014).                 https://doi.org/10.1021/jp408439j                
             
76.               Smallest fullerene-like silicon cage stabilized by a V2 unit

      Hong-Guang Xu, Xiang-Yu Kong, Xiao-Jiao Deng, Zeng-Guang Zhang, and Wei-Jun Zheng              
                    J. Chem. Phys. 140, 024308 (2014).                 https://doi.org/10.1063/1.4861053                
             
75.               Interaction of TiO2- with water: Photoelectron spectroscopy and density functional calculations

      Ren-Zhong Li, Hong-Guang Xu, Guo-Jin Cao, Xi-Ling Xu, Wei-Jun Zheng              
                     J. Chem. Phys. 139, 184303 (2013).                 https://doi.org/10.1063/1.4828815                
             
74.               Interaction of TiO+ with water : Infrared photodissociation spectroscopy and density functional calculations

      Hong-Guang Xu, Xiao-Na Li, Xiangyu Kong, Sheng-Gui He, Weijun Zheng              
                    Phys. Chem. Chem. Phys. 15, 17126 (2013).                 https://doi.org/10.1039/C3CP52823E               
             
73.               Structures, Stabilities and Physicochemical Properties of the Tautomers of Nucleobases

      Guo-Jin Cao, Wei-Jun Zheng              
                     Acta Phys.-Chim. Sin. 29, 2135 (2013).(in Chinese)   doi:               10.3866/PKU.WHXB201308011                
             
72.               Anomalous Property of Ag(BO2)2 Hyperhalogen: Does Spin-Orbit Coupling Matter?

      Hui Chen, Xiangyu Kong, Weijun Zheng, Jiannian Yao, Anil K. Kandalam, and Puru Jena              
                     ChemPhysChem 14, 3303 (2013).                 https://doi.org/10.1002/cphc.201300677                
             
71.               Photoelectron Spectroscopy and Theoretical Study of M(IO3)2– (M = H, Li, Na, K): Structural Evolution, Optical Isomers and Hyperhalogen Behavior

      Gao-Lei Hou, Miao Miao Wu, Hui Wen, Qiang Sun, Xue-Bin Wang, Wei-Jun Zheng              
                     J. Chem. Phys. 139, 044312 (2013).                 https://doi.org/10.1063/1.4816525                
             
70.               Photoelectron Spectroscopy and Density Functional Calculations of AgSin- (n=3-12) Clusters

      Xiangyu Kong, Xiaojiao Deng, Hong-Guang Xu, Zheng Yang, Xi-Ling Xu, Wei-Jun Zheng              
                     J. Chem. Phys. 138, 244312 (2013).                 https://doi.org/10.1063/1.4811659                
             
69.               Photoelectron spectroscopy and density functional theory study of ConO- (n=1-3)

      Ren-Zhong Li, Jun Liang, Xi-Ling Xu, Hong-Guang Xu, Wei-Jun Zheng              
                                   Chem. Phys. Lett. 575, 12 (2013).                 https://doi.org/10.1016/j.cplett.2013.04.066               
             
68.               Microsolvation of LiI and CsI in water: Anion photoelectron spectroscopy and ab initio calculations

      Ren-Zhong Li, Cheng-Wen Liu, Yi Qin Gao, Hong Jiang, Hong-Guang Xu, and Wei-Jun Zheng              
                     J. Am.               Chem.               Soc. 135, 5190 (2013).                 https://doi.org/10.1021/ja4006942                
             
67.               Investigation of ScmOn- (m=2-5, n=2-3) Clusters Using Photoelectron Spectroscopy and Density Functional Calculations

      Jinyun Yuan, Hong-Guang Xu, Xiangyu Kong, Weijun Zheng              
                     Chem. Phys. Lett. 564, 6 (2013).                 https://doi.org/10.1016/j.cplett.2013.01.068               
             
66.               Negative Ion Photoelectron Spectroscopy Reveals Thermodynamic Advantage of Organic Acids in Facilitating Formation of Bisulfate Ion Clusters: Atmospheric Implications

      Gao-Lei Hou, Wei Lin, S. H. M. Deng, Jian Zhang, Wei-Jun Zheng, Francesco Paesani, and Xue-Bin Wang              
                     J. Phys. Chem. Lett. 4, 779 (2013).                 https://doi.org/10.1021/jz400108y                
             
65.               Photoelectron spectroscopy and density functional calculations of CunBO2(OH)-(n=1, 2 )clusters

      Yuan Feng, Gao-Lei Hou, Hong-Guang Xu, Zeng-Guang Zhang, Weijun Zheng              
                     Chem. Phys. Lett. 545, 21 (2012).                 https://doi.org/10.1016/j.cplett.2012.07.030               
             
64.               Structures and Magnetic Properties of CrSin- (n=3-12) Clusters: Photoelectron Spectroscopy and Density Functional Calculations       

      Xiangyu Kong, Hong-Guang Xu, and Weijun Zheng              
                    J. Chem. Phys. 137, 064307 (2012).                 https://doi.org/10.1063/1.4742065                
             
63.               A Combined Gas-Phase Photoelectron Spectroscopic and Theoretical Study of Zeise's Anion and Its Bromine and Iodine Analogues

      Gao-Lei Hou, Hui Wen, Kenneth Lopata, Wei-Jun Zheng, Karol Kowalski, Niranjan Govind, Xue-Bin Wang, and Sotiris S. Xantheas              
                     Angew. Chem. Int. Ed. 51, 6356 (2012).                 https://doi.org/10.1002/anie.201201959                
             
62.               Photoelectron Spectroscopy of the Molecular Anions, ZrO-, HfO-, HfHO-, and HfO2H-     

      X. Li, W.-J. Zheng, A. Buonaugurio, A. Buytendyk, K. Bowen, and K. Balasubramanian              
                     J. Chem. Phys. 136, 154306 (2012).                 https://doi.org/10.1063/1.4704127                
             
61.               Photoelectron Spectroscopy and Density Functional Calculations of CuSin- (n=4-18) Clusters       

      Hong-Guang Xu, Miao Miao Wu, Zeng-Guang Zhang, Jinyun Yuan, Qiang Sun, Weijun Zheng              
                    J. Chem. Phys. 136, 104308 (2012).                 https://doi.org/10.1063/1.3692685                  pdf-file              
             
60.               Hydrogen bonds in the nucleobase-gold complexes: Photoelectron spectroscopy and Density functional calculations

      Guo-Jin Cao, Hong-Guang Xu, Ren-Zhong Li, Weijun Zheng              
                     J. Chem. Phys. 136, 014305 (2012).               https://doi.org/10.1063/1.3671945                  pdf-file   selected for               Vir. J. Bio. Phys. Res.               Volume 23, Issue 2              
             
59.               Structures of Al+(C2H4)n clusters: Mass-selected photodissociation and ab initio calculations

      Jinyun Yuan, Yuchao Zhao, Gaolei Hou, Zhen Gao, Weijun Zheng              
                    Int. J. Mass. Spectrom. 309, 49 (2012).                 https://doi.org/10.1016/j.ijms.2011.08.026                
             
58.               Photodissociation and Density Functional Calculations of Small VmOn+ Clusters

      Ren-Zhong Li, Hong-Guang Xu, Guo-Jin Cao, Yu-Chao Zhao, Wei-Jun Zheng              
                    Chin. J. Chem. Phys. 24, 572 (2011).                 https://doi.org/10.1088/1674-0068/24/05/572-579               
             
57.               Interaction of ComO- (m=1-3) with water: Anion photoelectron spectroscopy and density functional calculations

      Renzhong Li, Hong-Guang Xu, Guojin Cao, Yu-Chao Zhao, and Weijun Zheng              
                    J. Chem. Phys. 135, 134307 (2011).                 https://doi.org/10.1063/1.3644897               
             
56.               Microscopic solvation of NaBO2 in water: Anion photoelectron spectroscopy and ab initio calculations

      Yuan Feng, Min Cheng, Xiang-Yu Kong, Hong-Guang Xu, and Wei-Jun Zheng              
                     Phys. Chem. Chem. Phys. 13, 15865 (2011).                 https://doi.org/10.1039/C1CP20831D               
             
55.               Formation of nitric oxide and nitrous oxide in electron-irradiated H218O/N2 ice mixtures – evidence for the existence of free oxygen atoms in interstellar and solar system analog ices

      Weijun Zheng, Y. Seol Kim, Ralf I. Kaiser              
                    Phys. Chem. Chem. Phys. 13, 15749 (2011).                 https://doi.org/10.1039/C1CP20528E                
             
54.               Low temperature spectroscopy and irradiation effects on Solar System ices – Kuiper belt objects as a case study

      Ralf I. Kaiser, Weijun Zheng, Yoshihiro Osamura and Agnes H. H. Chang              
                    Phys. Chem. Chem. Phys. 13, 15747 (2011).                 https://doi.org/10.1039/C1CP90129J               
             
53.               Gas phase analogs of stable sodium-tin Zintl ions: Anion photoelectron spectroscopy and electronic structure

      W.-J. Zheng, O. C. Thomas, J. M. Nilles, K. H. Bowen, A. C. Reber, and S. N. Khanna              
                     J. Chem. Phys. 134, 224307 (2011).                 https://doi.org/10.1063/1.3597604               
             
52.               Probing the Entrance Channels of the X + CH4 → HX + CH3 (X = F, Cl, Br, I)Reactions via Photodetachment of X––CH4

      Min Cheng, Yuan Feng, Yikui Du, Qihe Zhu, Weijun Zheng, Gábor Czakó, and Joel M. Bowman              
                     J. Chem. Phys. 134, 191102 (2011).                 https://doi.org/10.1063/1.3591179                
             
51.               Electronic structure and reactivity of a biradical cluster: Sc3O6-

      Yan-Xia Zhao, Jin-Yun Yuan, Xun-Lei Ding,Sheng-Gui He and Wei-Jun Zheng              
                    Phys. Chem. Chem. Phys. 13, 10084 (2011).                 https://doi.org/10.1039/C0CP02095H                
             
50.               Structural and Bonding Properties of ScSin- (n=2-6) Clusters: Photoelectron Spectroscopy and Density Functional Calculations

      Hong-Guang Xu, Miao Miao Wu, Zeng-Guang Zhang, Qiang Sun, Weijun Zheng              
                     Chin. Phys. B 20, 043102 (2011).                 https://doi.org/10.1088/1674-1056/20/4/043102                
             
49.               Structures and Photoelectron Spectroscopy of Cun(BO2)m-(n, m=1-2) Clusters : Observation of Hyperhalogen Behavior

      Yuan Feng, Hong-Guang Xu, Weijun Zheng, Hongmin Zhao, Anil K. Kandalam and Puru Jena              
                     J. Chem. Phys. 134, 094309 (2011).                 https://doi.org/10.1063/1.3556818               
             
48.               Structures of Manganese Polysulfides: Mass-selected Photodissociation and Density Functional Calculations

      Yu-Chao Zhao, Jinyun Yuan, Zeng-Guang Zhang, Hong-Guang Xu, and Weijun Zheng              
                    Dalton Transactions 40, 2502 (2011).                 https://doi.org/10.1039/C0DT01179G                
             
47.               Adsorption of C2H Radical on Cobalt Clusters: Anion Photoelectron Spectroscopy and Density Functional Calculations

      Jinyun Yuan, Hong-Guang Xu, Zeng-Guang Zhang, Yuan Feng, Weijun Zheng              
                                   J. Phys. Chem. A 115, 182 (2011).                 https://doi.org/10.1021/jp108847f               
             
46.               Anion photoelectron spectroscopy and density functional study of small aluminum-vanadium oxide clusters

      Zeng-Guang Zhang, Hong-Guang Xu, Xiangyu Kong, and Weijun Zheng              
                     J. Phys. Chem. A 115, 13 (2011).                 https://doi.org/10.1021/jp109221m                
             
45.               Photoelectron spectroscopy and DFT study of TiAlOy- (y=1-3) and TiAl2Oy- (y=2-3) clusters

      Zeng-Guang Zhang, Hong-Guang Xu, Yuchao Zhao, and Weijun Zheng              
                     J. Chem. Phys. 133, 154314 (2010).                 https://doi.org/10.1063/1.3505298                
             
44.                Electronic structure and properties of isoelectronic magic clusters: Al13X (X = H, Au, Li, Na, K, Rb, Cs)

       Y.J. Ko, A. Shakya, H.P. Wang, A. Grubisic, W.J. Zheng, M. Goetz, G. Gantefoer, K.H. Bowen, P. Jena, and B. Kiran              
                      J. Chem. Phys. 133, 124308 (2010).                 https://doi.org/10.1063/1.3490401               
             
43.                Photoelectron Spectroscopy and Density-Functional Study of Sc2Sin- (n=2-6) Clusters

       Hong-Guang Xu, Zeng-Guang Zhang, Yuan Feng, and Weijun Zheng              
                                    Chem. Phys. Lett. 498, 22 (2010).                 https://doi.org/10.1016/j.cplett.2010.08.027                
             
42.                Photodissociation and DFT Investigation of V+(C2H4)n (n=1-3) Complexes

       Jinyun Yuan, Zeng-Guang Zhang, Yuchao Zhao, Gao-Lei Hou, Hong-Guang Xu, and Weijun Zheng              
                     Int. J. Mass. Spectrom. 295, 36 (2010).                 https://doi.org/10.1016/j.ijms.2010.06.018                
             
41.               Cosmic-Ray Mediated Formation of Benzene on the Surface of Saturn's Moon Titan

      L. Zhou, W. J. Zheng, R. I. Kaiser, A. Landera, A. M. Mebel, M.-C. Liang, Y. L. Yung              
                     Astrophysical Journal 718, 1243 (2010).                 https://doi.org/10.1088/0004-637X/718/2/1243               
             
40.               Investigation of the Superatomic Character of Al13 via its Interaction with Sulfur Atoms

      Zeng-Guang Zhang, Hong-Guang Xu, Yuan Feng, and Weijun Zheng              
                     J. Chem. Phys. 132, 161103 (2010).                 https://doi.org/10.1063/1.3374431               
             
39.               Formation of Hydroxylamine (NH2OH) in Electron Irradiated Ammonia-Water Ices

      Weijun Zheng,and Ralf I. Kaiser              
                     J. Phys. Chem. A 114, 5251 (2010).                 https://doi.org/10.1021/jp911946m               
             
38.                Photoelectron Spectroscopy and Density Functional Calculations of FenBO2- Clusters

      Yuan Feng, Hong-Guang Xu, Zeng-Guang Zhang, Zhen Gao, Weijun Zheng              
                    J. Chem. Phys. 132, 074308 (2010).                 https://doi.org/10.1063/1.3299290               
             
37.                Vanadium-Doped Small Silicon Clusters: Photoelectron Spectroscopy and Density-Functional Calculations

       Hong-Guang Xu, Zeng-Guang Zhang, Yuan Feng, Jinyun Yuan, Yuchao Zhao, and Weijun Zheng              
                    Chem. Phys. Lett. 487, 204 (2010).                 https://doi.org/10.1016/j.cplett.2010.01.050               
             
36.                Modification of Reflectron Time-of-Flight Mass Spectrometer for Photodissociation of Mass-Selected Cluster Ions

       Yu-chao Zhao, Zeng-guang Zhang, Jin-yun Yuan, Hong-guang Xu, Wei-jun Zheng              
                      Chin. J. Chem. Phys. 22, 655 (2009).                 https://doi.org/10.1088/1674-0068/22/06/655-662               
             
35.                Theoretical and REMPI spectroscopic study on phenylhydrazine and phenylhydrazine–(Ar)n (n = 1, 2) van der Waals complexes

       Daoqing Xiao, Dan Yu, Xiling Xu, Zijun Yu, Min Cheng, Yikui Du, Weijun Zheng, Qihe Zhu and Cunhao Zhang              
                      Phys. Chem. Chem. Phys. 11, 3532 (2009).                 https://doi.org/10.1039/B818688J               
             
34.                On the State of Water Ice on Saturn's Moon Titan and Implications to Icy Bodies in the Outer Solar System

       Weijun Zheng, David Jewitt, and Ralf I. Kaiser              
                      J. Phys. Chem. A 113, 11174 (2009).                 https://doi.org/10.1021/jp903817y               
             
33.                Infrared Spectra of Ammonia-Water Ices

       Weijun Zheng, David Jewitt, and Ralf I. Kaiser              
                      Astrophysical Journal Supplement Series 181, 53 (2009).                 https://doi.org/10.1088/0067-0049/181/1/53                
             
32.                Photoelectron Spectroscopic Study of Iron-Benzene Cluster Anions

       Weijun Zheng, Soren N. Eustis, Xiang Li, John M. Nilles, Owen C. Thomas, and Kit H. Bowen, Anil K. Kandalam              
                     Chem. Phys. Lett. 462, 35 (2008).                 https://doi.org/10.1016/j.cplett.2008.07.052               
             
31.                Electronic and geometrical structure of Mn13 anions, cations, and neutrals

       G. L. Gutsev, M. D. Mochena, Charles W. Bauschlicher, Jr., W.-J. Zheng, O. C. Thomas, and Kit H. Bowen              
                      J. Chem. Phys. 129, 044310 (2008).                 https://doi.org/10.1063/1.2956494               
             
30.                 Anion Photoelectron Spectroscopy of TaOn-(n=1-3)

       Weijun Zheng, Xiang Li, Soren Eustis and Kit Bowen              
                     Chem. Phys. Lett. 460,68 (2008).                 https://doi.org/10.1016/j.cplett.2008.06.016               
             
29.                 Formation of Nitrogen and hydrogen-Bearing Molecules in Solid Ammonia and Implications to Solar System and Interstellar Ices

        Weijun Zheng, David Jewitt, Yoshihiro Osamura, and Ralf I. Kaiser              
                      Astrophysical Journal 674, 1242 (2008).                 https://doi.org/10.1086/523783               
             
28.                  On the Formation of Carbonic Acid (H2CO3) in Solar System ices

        Weijun Zheng, and Ralf I. Kaiser              
                      Chem. Phys. Lett. 450, 55 (2007).                 https://doi.org/10.1016/j.cplett.2007.10.094               
             
27.                 Anion Photoelectron Spectroscopy of Au(H2O)1-2, Au2-(D2O)1-4, and AuOH

        Weijun Zheng, Xiang Li, Soren Eustis, Andrej  Grubisic, Owen Thomas, Kit H. Bowen, and Helen de Clercq              
                      Chem. Phys. Lett. 444, 232 (2007).                 https://doi.org/10.1016/j.cplett.2007.07.036               
             
26.                  An Infrared Spectroscopy Study of the Phase Transition in Solid Ammonia

        Weijun Zheng, and Ralf I. Kaiser              
                      Chem. Phys. Lett.  440, 229 (2007).                 https://doi.org/10.1016/j.cplett.2007.04.070                             
             
25.                 Mechanistical Studies on the Formation of Isotopomers of Hydrogen Peroxide (HOOH), Hydrotrioxy (HOOO), and Dihydrogentrioxide (HOOOH) in Electron-Irradiated H2O-18/O2 Ice Mixtures

        Weijun Zheng, David Jewitt, and Ralf I. Kaiser              
                      Phys. Chem. Chem. Phys. 9, 2556 (2007).                 https://doi.org/10.1039/B700814G                             
             
24.                 Electron Irradiation of Crystalline and Amorphous D2O Ice

        Weijun Zheng, David Jewitt, and Ralf I. Kaiser              
                      Chem. Phys. Lett. 435, 289 (2007).                 https://doi.org/10.1016/j.cplett.2007.01.013               
             
23.                 Laboratory Investigations on the Infrared Absorptions of Germanium-bearing Molecules—Directing the Identification of Organo-Germanium Molecules in the Atmospheres of Jupiter and Saturn

       William Carrier, Yoshihiro Osamura, Weijun Zheng, and Ralf I. Kaiser              
                      Astrophysical Journal 654, 687 (2007).                 https://doi.org/10.1086/507441               
             
22.                 Infrared spectroscopic identification of digermene, Ge2H4 (X1Ag), and of the  digermenyl radical, Ge2H3(X2A"), together with their deuterated counterparts in low temperature germane matrices

        William Carrier, Weijun Zheng, Yoshihiro Osamura,  and Ralf I. Kaiser              
                      Chem. Phys. 330, 275 (2006).                  https://doi.org/10.1016/j.chemphys.2006.08.022               
             
21.                Mn               n               -               Clusters: Size-Induced Transition to Half-Metallicity

       Julius Jellinek, Paulo H. Acioli, Juan Garcia-Rodeja, Weijun Zheng, Owen C. Thomas, and K. H. Bowen, Jr.              
                     Phys. Rev. B 74, 153401 (2006).                 https://doi.org/10.1103/PhysRevB.74.153401               
             
20.                 Temperature Dependence of the Formation of Hydrogen, Oxygen, and Hydrogen Peroxide in Electron Irradiated Crystalline Water Ice

        Weijun Zheng, David Jewitt, and Ralf I. Kaiser              
                      Astrophysical Journal 648, 753 (2006).                 https://doi.org/10.1086/505901               
             
19.                 Infrared spectroscopic characterization of digermyl (Ge2H5) and D5-digermyl (Ge2D5) radicals in low temperature germane matrices

        William Carrier, Weijun Zheng, Yoshihiro Osamura,  and Ralf I. Kaiser              
                      Chem. Phys. 325, 499 (2006).                 https://doi.org/10.1016/j.chemphys.2005.11.046               
             
18.                 The ionic KAl13 molecule: A stepping stone to cluster-assembled materials

        W.-J. Zheng, O. C. Thomas, T. P. Lippa, S.-J. Xu, and K. H. Bowen, Jr.              
                      J. Chem. Phys. 124, 144304 (2006).                 https://doi.org/10.1063/1.2184316               
             
17.                 Formation of Hydrogen, Oxygen, and Hydrogen Peroxide in Electron Irradiation Crystalline Water Ice   

        Weijun Zheng, David Jewitt, and Ralf I. Kaiser              
                      Astrophysical Journal 639, 534 (2006).                 https://doi.org/10.1086/499231               
             
16.                 Electronic Structure Differences in ZrO2 vs. HfO2

        Weijun Zheng, Kit H. Bowen, Jr. Jun Li, Iwona Dąbkowska,and Maciej Gutowski              
                      J. Phys. Chem. A 109, 11521 (2005).                 https://doi.org/10.1021/jp053593e               
             
15.                On the Interaction of Electrons with Betaine Zwitterions

       Weijun Zheng, Shoujun Xu, Dunja Radisic, Sarah Stokes, Xiang Li, and Kit H. Bowen, Jr.              
                      J. Chem. Phys. 122, 101103 (2005).                  https://doi.org/10.1063/1.1871912                
             
14.                The stabilization of arginine's zwitterion by dipole-binding of an excess electron

       Shoujun Xu, Weijun Zheng, Dunja Radisic, and Kit H. Bowen, Jr.              
                     J. Chem. Phys. 122, 091103 (2005).                 https://doi.org/10.1063/1.1864952               
             
13.                 Photoelectron Spectroscopy of Chromium-doped Silicon Cluster Anions

       Weijun Zheng, J. Michael Nilles, Dunja Radisic, and Kit H. Bowen, Jr.              
                     J. Chem. Phys. 122, 071101 (2005).                 https://doi.org/10.1063/1.1851984               
             
12.                Photoelectron Spectroscopy of Nickel-Benzene Cluster Anions

       Weijun Zheng, John M. Nilles, Owen C. Thomas, and Kit H. Bowen, Jr              
                     J. Chem. Phys. 122, 044306 (2005).                 https://doi.org/10.1063/1.1839864               
               
11.                Photoelectron Spectroscopy of Titanium-Benzene Cluster Anions

       Weijun Zheng, John M. Nilles, Owen C. Thomas, and Kit H. Bowen, Jr              
                     Chem. Phys. Lett. 401, 266 (2005).                 https://doi.org/10.1016/j.cplett.2004.08.149               
             
10.                Magnetic Isomers and Isomags in Mn5O and Mn6O Clusters

      N. O. Jones, S. N. Khanna, T. Baruah, M. R. Pederson, W.-J. Zheng, J. M. Nilles, and K. H. Bowen              
                    Phys. Rev. B 70, 134422 (2004).                 https://doi.org/10.1103/PhysRevB.70.134422               
               
9.                  Spectroscopic signature of magnetic bistability in Mn2O- anions and its implications for piezomagnetism at the nanoscale    

      S. N. Khanna and P. Jena, W.-J. Zheng, J. M. Nilles, and K. H. Bowen              
                    Phys. Rev. B 69,144418 (2004).                 https://doi.org/10.1103/PhysRevB.69.144418               
               
8.                 Boron cluster anions containing multiple B12 icosahedra       

      S.-J. Xu a, J.M. Nilles, D. Radisic, W.-J. Zheng, S. Stokes, K.H. Bowen, R.C. Becker, I. Boustani                     
                    Chem. Phys. Lett. 379, 282 (2003).                 https://doi.org/10.1016/j.cplett.2003.07.020               
             
7.                Onset of Metallic Behavior in Magnesium Clusters

     Owen C. Thomas, Weijun Zheng, Shoujun Xu, and Kit H. Bowen, Jr.              
                   Phys. Rev. Lett. 89, 213403 (2002).                 https://doi.org/10.1103/PhysRevLett.89.213403               
             
6.                Cobalt-benzene cluster anions: Mass spectrometry and negative ion photoelectron spectroscopy

     M. Gerhards, O. C. Thomas, J. M. Nilles, W.-J. Zheng, and K. H. Bowen, Jr.              
                   J. Chem. Phys. 116, 10247 (2002).                 https://doi.org/10.1063/1.1477924               
             
5.                In search of theoretically predicted magic clusters: Lithium-doped aluminum cluster anions

     O. C. Thomas, W.-J. Zheng, T. P. Lippa, S.-X. Xu, S.A. Lyapustina, and K. H. Bowen, Jr.              
                   J. Chem.  Phys. 114, 9895 (2001).                 https://doi.org/10.1063/1.1365110               
             
4.                 Magic numbers in copper-doped aluminum cluster anions

     Owen C. Thomas, Weijun Zheng, and Kit H. Bowen, Jr.              
                   J. Chem. Phys. 114, 5514 (2001).                 https://doi.org/10.1063/1.1349547               
             
3.                 Formation of lead/sulfur binary cluster ions by laser ablation

     Jian-bo Liu, Chun-ying Han, Wei-jun Zheng, Zhen Gao, Qi-he Zhu              
                   Int. J. Mass. Spectrom. 189, 147 (1999).                  https://doi.org/10.1016/S1387-3806(99)00068-8               
             
2.                Formation, reaction and photodissociation of lead/sulfur clusters

    Jian-bo Liu, Chun-ying Han, Wei-jun Zheng, Zhen Gao, Fan-ao Kong              
                   ACTA PHYS-CHIM SIN, 15, (1): 22-27, (1999).   doi:               10.3866/PKU.WHXB19990105              
             
1.                Laser Double Ablation Cluster Reactor

     Peng Liu, Weijun Zheng, Zhen Gao, Qihe Zhu              
                   Chinese J. Chem. Phys. 11 (4), 303 (1998).                
             
             
                            Conference Presentations:              
 

2023   分子天体化学学术研讨会, 2023年8月20-24日, 乌鲁木齐, 新疆, 中国。 报告: 外太阳系天体表面冰层的实验模拟研究--奥陌陌及其他              
             
2023   第十八届全国化学动力学会议, 2023年8月17-20日, 大连, 辽宁, 中国。 报告: 外太阳系天体表面冰层的实验模拟研究--奥陌陌及其他              
             
2023   第四届团簇科学与原子制造研讨会, 2023年4月21-23日, 西安，中国。邀请报告: 金属碳化物团簇的光电子能谱和结构性质研究              
             
2022   第三届团簇科学与原子制造研讨会, 2022年8月6-9日, 太原，中国。 报告：Anion Photoelectron Spectroscopy and Theoretical Study of Size-Selected Metal-Doped Semiconductor Clusters

 

2020   第二届团簇科学与原子制造研讨会, 2020年11月6-8, 重庆，中国。 邀请报告: 利用负离子光电子能谱获得化学反应势能面的信息              
             
2019   原子团簇与器件制造, 2019年11月16-18, 南京，江苏，中国。 邀请报告: 金属掺杂半导体团簇的光电子能谱研究              
             
2019   第十六届全国化学动力学会议, 2019年10月11-14日, 2017, 苏州, 江苏, 中国.              
             
2019   第九届成像技术及其在原子分子物理中的应用学术研讨会, 2019年6月13-16, 大连，辽宁，中国。 邀请报告: 金属掺杂半导体团簇的光电子能谱研究              
             
2019   International Workshop on Astrochemistry (2019), May 17-20, 2019, Xi'An China.

 

2018   星际介质中的化学反应动力学，2018年9月21-24日, 乌鲁木齐，新疆，中国。报告：外太阳系冰层的实验模拟研究              
             
2018   International Symposium on New Molecules and Clusters, August 18-20, 2018, Shanghai, China.              
             
2018   19th International Symposium on Small Particles and Inorganic Clusters (ISSPIC XIX)，August 12-17,2018, Hangzhou, Zhejiang Province, China. Talk: Photoelectron Spectroscopy and Theoretical Investigate of Transition Metal-Doped Semiconductor Clusters              
             
2018   2018团簇科学与纳米技术青年科学论坛，2018年8月10-12日, 南京，江苏，中国。报告：Microsolvation of Salts in Water              
             
2018   星际物理与化学(昆明2018), 2018年7月27-31日, 昆明，云南，中国。报告：Experimental study of simulated solar system ices              
             
2018   中国化学会第31届年会，2018年5月4-8日, 杭州，浙江，中国。              
             
2018   第八届全国物理无机化学学术会议, 2018年4月13-16日, 太原, 山西，中国。邀请报告: 金属掺杂半导体团簇的研究              
             
2018   Gordon Research Conference on Molecular and Ionic Clusters, February 25, 2018 - March 02, 2018 at Renaissance Tuscany Il Ciocco in Lucca (Barga), Italy. Invited Talk: Microsolvation of Salts in Water: Photoelectron spectroscopy and theoretical studies of size-selected salt-water clusters              
             
2017   第八届原子分子物理成像研讨会, 2017年11月24-27, 六安，安徽，中国。 邀请报告: 从团簇负离子的光电子能谱获得有关化学反应势能面的信息              
             
2017   The 8th International Conference on Theory of Atomic & Molecular Clusters, September 17-22, 2017, Beijing, China. Invited Talk: Microsolvation of Salts in Water: Photoelectron spectroscopy and theoretical studies of size-selected salt-water clusters              
             
2017   The 15th National Chemical Dynamics Symposium, Augst 18-21, 2017, Nanjing, Jiangsu Province, China. Invited Talk: Microsolvation of Salts in Water: Photoelectron spectroscopy and theoretical studies of size-selected salt-water clusters              
             
2016   团簇和气溶胶研讨会,2016年8月1-3日, 北京, 中国. 邀请报告: 盐类在水中溶解的微观机理研究              
             
2016   第七届原子分子物理成像研讨会, 2016年7月17-20, 张掖，甘肃，中国。 邀请报告: 尺寸选择的金属掺杂半导体团簇的光电子能谱研究              
             
2016   中国化学会第30届年会，2016年7月1日-7月4日, 大连，辽宁，中国。              
             
2016   International Symposium on New Molecules and Clusters, May 27-30, 2016, Fudan University, Shanghai, China. Invited Talk: Microsolvation of Salts in Water: Photoelectron spectroscopy and theoretical studies of size-selected salt-water clusters              
             
2016   Symposium on Size Selected Clusters, February 28-March 4, 2016 Davos in Switzerland. Invited Talk: Microsolvation of Salts in Water: Photoelectron spectroscopy and theoretical studies of size-selected salt-water clusters              
             
2014   2014中国化学会第29届学术年会, 化学动力学分会, August 3-7，2014, Beijing, China. Invited Talk: 单价盐在水中溶解的微观机理              
             
2013   China-Europe International Workshop on Alloy Nanoparticles, November 17-21, 2013, Beijing, China. Invited Talk: Photoelectron spectroscopy and density functional calculations of transition metal-doped silicon clusters              
             
2013   第五届原子分子物理成像研讨会, October 20-24, Beijing China. Invited Talk: Microscopic Solvation of Monovalent Salts in Water              
             
2012   Annual Meeting of Beijing National Laboratory of Molecular Sciences, August 24-25, 2012. Invited Talk: Microscopic Solvationof MonovalentSalts in Water              
             
2012   Dalian Institute of Chemical Physics, Beijing, China. June 21, 2012. Invited Talk: Microscopic Solvationof MonovalentSalts in Water              
             
2011   Frontiers in Theoretical Physics —Biophysics 2011              
       December 5-6, 2011, Beijing, China. Invited Talk: Microscopic solvation of monovalent salts in water: Anion photoelectron spectroscopy and ab initio calculations              
             
2011   The 12th National Chemical Dynamics Symposium              
       June 10-14, 2011, Chengdu, Sichuan Province, China. Invited Talk: Microscopic solvation of NaBO2 in water              
             
2010   PACIFICHEM 2010, SYMPOSIA: (31) Kuiper Belt Objects - Laboratory Studies, Models, Theory, and Observations,              
       December 15-20, 2010. Honolulu, Hawaii, USA. Contributed Talk: Electron irradiation of crystalline water ice and ammonia-water ice              
             
2010   2010 Annual Meeting of Asian CORE Program "Frontiers of Materials, Photo-, and Theoretical Molecular Sciences"              
       February 28- March 2, 2010, Taipei, Taiwan. Invited Talk: Photoelectron Spectroscopy of Mass-Selected Cluster Anions              
             
2009   The 11th National Chemical Dynamics Symposium              
       August 13-17, 2009, Yichang, China. Invited Talk: Photoelectron Spectroscopy of Mass-Selected Cluster Anions              
             
2007   BioAstronomy 2007 – Molecules, Microbes and Extraterrestrial Life,              
       July 16-20, 2007, San Juan, Puerto Rico. Poster: Laboratory Studies of Solid Water and Ammonia Hydrate relevant to Outer Solar System Ices              
             
2007   Workshop on Titan – Observations, Experiments, Computations, and Modeling, February 5-7, 2007, Honolulu, Hawaii, USA.              
             
2005   PACIFICHEM 2005, SYMPOSIA: (47) Astrochemistry - From Laboratory Studies to Astronomical Observations,              
       December 15-20, 2005. Honolulu, Hawaii, USA. Poster: Water ice irradiated with electrons              
             
2005   NAI 2005 Biennial Meeting of the NASA Astrobiology Institute,              
       April 10-14, 2005, Boulder, Colorado, USA. Poster:  Irradiation effects on Amorphous and Crystalline Water Ices              
             
2003   International Symposium on Clusters And Nano-Assemblies: Physical and Biological Systems,              
       November 10-13, 2003, Richmond, Virginia, USA. Poster: Photoelectron Spectroscopy and Mass Spectrometry of Transition Metal-Benzene Cluster Anions              
             
2003   Gordon Research Conference on Electronic Spectroscopy & Dynamics,              
       July 6-11, 2003, Lewiston, Maine, USA. Poster: Photoelectron Spectroscopy of Metal Cluster Anions              
             
2002   American Chemical Society 224th National Meeting and Exposition,              
           August 18-22, 2002, Boston, Massachusetts, USA              
             
2001   Gordon Research Conference on Photoions, Photoionization and Photodetachment,               
           July 8-13, 2001, Williamstown, Massachusetts, USA. Poster: Magic numbers in copper-doped aluminum cluster anions              
             
2000   Ohio State University International Symposium on Molecular Spectroscopy,              
           June 12-16, 2000, Columbus, Ohio, USA.               
             
1999   Gordon Research Conference on Photoions, Photoionization and Photodetachment,              
           July 18-23, 1999, Plymouth, New Hampshire, USA. Poster: Photoelectron Spectroscopy of Cluster Anions.              
             
1999   Centennial Celebration of the American Physical Society,              
           March 22-26, 1999, Atlanta, Georgia, USA.              
             
1998   7th Annual Workshop of the Consortium for Nanostructured Materials,              
          October 29-31, 1998, Richmond, Virginia, USA.              
 


 

 


             

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Publications Related to Astrochemistry

22. Size-selected anion photoelectron spectroscopy and density functional theory study of MnCn−/0 (n = 3-10): odd-even alternation and linear-cyclic structure competition
      Xi-Ling Xu, Bin Yang, Chao-Jiang Zhang, Hong-Guang Xu, Wei-Jun Zheng
      J. Chem. Phys. 150, 074304 (2019).   https://doi.org/10.1063/1.5084310   pdf-file

21. Structural and Bonding Properties of BS−/0 and BS3−/0
      Li-Juan Zhao, Xi-Ling Xu, Hong-Guang Xu, Gang Feng, Wei-Jun Zheng
      New J. Chem. 42, 16021 (2018).   https://doi.org/10.1039/C8NJ01835A   pdf-file

20. Structural and Electronic Properties of HCnS− (n = 4–11): Anion Photoelectron Spectroscopy and Density Functional Calculations
      Xi-Ling Xu, Bin Yang, Hong-Guang Xu, Xiao-Jiao Deng, and Wei-Jun Zheng
      RSC Adv. 6, 78064 (2016).    https://doi.org/10.1039/C6RA13665F   pdf-file

19. Superhalogen Properties of BS2− and BSO−: Photoelectron Spectroscopy and Theoretical Calculations
      Li-Juan Zhao, Hong-Guang Xu, Gang Feng, Peng Wang, Xi-Ling Xu, Wei-Jun Zheng
      Phys. Chem. Chem. Phys. 18, 6175 (2016).   https://doi.org/10.1039/C5CP07673K   pdf-file

18. Photoelectron Spectroscopy and Density Functional Calculations of CnSm- (n = 2-7; m = 1, 2) clusters
      Xi-Ling Xu, Xiao-Jiao Deng, Hong-Guang Xu and Wei-Jun Zheng
      Phys. Chem. Chem. Phys. 17, 31011 (2015).   https://doi.org/10.1039/C5CP04482K   pdf-file

17. Photoelectron spectroscopy and ab initio calculations of small SinSm- (n = 1,2; m = 1-4) clusters
      Xi-Ling Xu, Xiao-Jiao Deng, Hong-Guang Xu, and Wei-Jun Zheng
      J. Chem. Phys. 141, 124310 (2014).   https://doi.org/10.1063/1.4896384   pdf-file

16. Formation of nitric oxide and nitrous oxide in electron-irradiated H218O/N2 ice mixtures – evidence for the existence of free oxygen atoms in interstellar and solar system analog ices
     Weijun Zheng, Y. Seol Kim, Ralf I. Kaiser
     Phys. Chem. Chem. Phys. 13, 15749 (2011).   https://doi.org/10.1039/C1CP20528E   pdf-file

15. Low temperature spectroscopy and irradiation effects on Solar System ices – Kuiper belt objects as a case study
      Ralf I. Kaiser, Weijun Zheng, Yoshihiro Osamura and Agnes H. H. Chang
      Phys. Chem. Chem. Phys. 13, 15747 (2011).   https://doi.org/10.1039/C1CP90129J   pdf-file

14. Cosmic-Ray Mediated Formation of Benzene on the Surface of Saturn's Moon Titan
      L. Zhou, W. J. Zheng, R. I. Kaiser, A. Landera, A. M. Mebel, M.-C. Liang, Y. L. Yung
      Astrophysical Journal 718, 1243 (2010).   https://doi.org/10.1088/0004-637X/718/2/1243   pdf-file

13. Formation of Hydroxylamine (NH2OH) in Electron Irradiated Ammonia-Water Ices
      Weijun Zheng,and Ralf I. Kaiser
      J. Phys. Chem. A 114, 5251 (2010).   https://doi.org/10.1021/jp911946m   pdf-file

12. On the State of Water Ice on Saturn's Moon Titan and Implications to Icy Bodies in the Outer Solar System
      Weijun Zheng, David Jewitt, and Ralf I. Kaiser
      J. Phys. Chem. A 113, 11174 (2009).   https://doi.org/10.1021/jp903817y    pdf-file

11. Infrared Spectra of Ammonia-Water Ices
      Weijun Zheng, David Jewitt, and Ralf I. Kaiser
      Astrophysical Journal Supplement Series 181, 53 (2009).   https://doi.org/10.1088/0067-0049/181/1/53   pdf-file

10. Formation of Nitrogen and hydrogen-Bearing Molecules in Solid Ammonia and Implications to Solar System and Interstellar Ices
      Weijun Zheng, David Jewitt, Yoshihiro Osamura, and Ralf I. Kaiser
      Astrophysical Journal 674, 1242 (2008).   https://doi.org/10.1086/523783   pdf-file

9. On the Formation of Carbonic Acid (H2CO3) in Solar System ices
    Weijun Zheng, and Ralf I. Kaiser
    Chem. Phys. Lett. 450, 55 (2007).   https://doi.org/10.1016/j.cplett.2007.10.094   pdf-file

8. An Infrared Spectroscopy Study of the Phase Transition in Solid Ammonia
    Weijun Zheng, and Ralf I. Kaiser
    Chem. Phys. Lett. 440, 229 (2007).   https://doi.org/10.1016/j.cplett.2007.04.070   pdf-file

7. Mechanistical Studies on the Formation of Isotopomers of Hydrogen Peroxide (HOOH), Hydrotrioxy (HOOO), and Dihydrogentrioxide (HOOOH) in Electron-Irradiated H2O-18/O2 Ice Mixtures
    Weijun Zheng, David Jewitt, and Ralf I. Kaiser
    Phys. Chem. Chem. Phys. 9, 2556 (2007).   https://doi.org/10.1039/B700814G   pdf-file

6. Electron Irradiation of Crystalline and Amorphous D2O Ice
    Weijun Zheng, David Jewitt, and Ralf I. Kaiser
    Chem. Phys. Lett. 435, 289 (2007).   https://doi.org/10.1016/j.cplett.2007.01.013   pdf-file

5. Laboratory Investigations on the Infrared Absorptions of Germanium-bearing Molecules—Directing the Identification of Organo-Germanium Molecules in the Atmospheres of Jupiter and Saturn
    William Carrier, Yoshihiro Osamura, Weijun Zheng, and Ralf I. Kaiser
    Astrophysical Journal 654, 687 (2007).   https://doi.org/10.1086/507441   pdf-file

4. Infrared spectroscopic identification of digermene, Ge2H4 (X1Ag), and of the digermenyl radical, Ge2H3(X2A"), together with their deuterated counterparts in low temperature germane matrices
    William Carrier, Weijun Zheng, Yoshihiro Osamura, and Ralf I. Kaiser
    Chem. Phys. 330, 275 (2006).   https://doi.org/10.1016/j.chemphys.2006.08.022   pdf-file

3. Temperature Dependence of the Formation of Hydrogen, Oxygen, and Hydrogen Peroxide in Electron Irradiated Crystalline Water Ice
    Weijun Zheng, David Jewitt, and Ralf I. Kaiser
    Astrophysical Journal 648, 753 (2006).   https://doi.org/10.1086/505901   pdf-file

2. Infrared spectroscopic characterization of digermyl (Ge2H5) and D5-digermyl (Ge2D5) radicals in low temperature germane matrices
    William Carrier, Weijun Zheng, Yoshihiro Osamura, and Ralf I. Kaiser
    Chem. Phys. 325, 499 (2006).   https://doi.org/10.1016/j.chemphys.2005.11.046   pdf-file

1. Formation of Hydrogen, Oxygen, and Hydrogen Peroxide in Electron Irradiation Crystalline Water Ice
    Weijun Zheng, David Jewitt, and Ralf I. Kaiser
    Astrophysical Journal 639, 534 (2006).   https://doi.org/10.1086/499231   pdf-file


Conference Presentations:

2019 Astrochemistry (2019), May 17-20, 2019, Xi'an, China.

2018 星际介质中的化学反应动力学，2018年9月21-24日, 乌鲁木齐，新疆，中国。报告：外太阳系冰层的实验模拟研究

2018 星际物理与化学(昆明2018), 2018年7月27-31日, 昆明，云南，中国。报告：Experimental study of simulated solar system ices

2010 PACIFICHEM 2010, SYMPOSIA: (31) Kuiper Belt Objects - Laboratory Studies, Models, Theory, and Observations,
December 15-20, 2010. Honolulu, Hawaii, USA. Contributed Talk: Electron irradiation of crystalline water ice and ammonia-water ice

2007 BioAstronomy 2007 – Molecules, Microbes and Extraterrestrial Life,
July 16-20, 2007, San Juan, Puerto Rico. Poster: Laboratory Studies of Solid Water and Ammonia Hydrate relevant to Outer Solar System Ices

2007 Workshop on Titan – Observations, Experiments, Computations, and Modeling, February 5-7, 2007, Honolulu, Hawaii, USA.

2005 PACIFICHEM 2005, SYMPOSIA: (47) Astrochemistry - From Laboratory Studies to Astronomical Observations,
December 15-20, 2005. Honolulu, Hawaii, USA. Poster: Water ice irradiated with electrons

2005 NAI 2005 Biennial Meeting of the NASA Astrobiology Institute,
April 10-14, 2005, Boulder, Colorado, USA. Poster: Irradiation effects on Amorphous and Crystalline Water Ices