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2024年发表论文

(1) Li, Y.;# Mou, L.-H.;# Jiang, G.-D.; Li, Z.-Y.; *He, S.-G.; *Chen, H. Toward Designing Reactive Metal Clusters for Dinitrogen Activation: A Guideline Based on N2 Initial Adsorption, Ingor. Chem. 2024, accepted.

(2) Sun, C.-M.; Wei, G.-P.; *Yang, Y.; *Zhao, Y.-X. Thermal Reaction of NiAl3O6+ and Al4O6+ with Methane: Reactivity Enhanced by Doping, J. Phys. Chem. A 2024, 128, 1218-1225.

(3) Zhao, X.-G.,# *Zhao, Y.-X.,# *He, S.-G. Reactivity of Atomic Oxygen Radical Anions on Metal Oxide Clusters, ChemPlusChem 2024in revision.

(4) Zhou, H.; Ruan, M.; Liu, Q.-Y.; Zhao, Y.-X.;Wang, R.-Y.; *Yang, Y.; *He, S.-G. Size-Dependent Reactivity of VnO+ (n =1-9) Clusters with Ethane. Phys. Chem. Chem. Phys. 2024, 26, 14186.

(5) Hu, Y.-Z.; Wei, G.-P.; Zhao, Y.-X.; Liu, Q.-Y.; *He, S.-G. Experimental Reactivity of (MoO3)NO (N = 1–21) Cluster Anions with C1-C4 Alkanes: A Simple Model to Predict the Reactivity with Methane. J. Phys. Chem. A 2024, in revision.

(6) Zhao, A.; Liu, Qing.-Y.; Li, Z.-Y.; *Li, X.-N.; *He, S.-G. Reverse Water-Gas Shift Catalyzed by RhnVO3,4-(n = 3-7) Cluster Anions under Variable Temperatures.  Dalton T. 202453, 8347-8355.

(7) Li, Q.; *Liu, Q.-Y.; *Zhao, Y.-X.; He, S.-G. Conversion of Methane at Room Temperature Mediated by the Ta-Ta σ-BondJACS Au 2024DOI: 10.1021/jacsau.4c00032.

(8) Zhao, X.-G.;# Yang, Q.;# Xu, Y.; Liu, Q.-Y.; Li, Z.-Y.; Liu, X.-X.; *Zhao, Y.-X.; *He, S.-G. Machine Learning for Experimental Reactivity of a Set of Metal Clusters toward C-H ActivationJ. Am. Chem. Soc 2024, 146, 12485-12495.

(9) Yang, Q.; Li, Z.-Y.; Rodríguez-Kessler, Peter*He, S.-G. Accelerated Global Optimization via the Deep Neural Network Complemented with Transfer Learning and Genetic AlgorithmChinese J. Chem. Phys. 2024, accepted.

(10) Li, Z.-Y.; Liu, Q.-Y.; *He, S.-G. Spectroscopic Characterization of Thermal Methane Acitivation by Lewis-Acid-Base Pair in a Gas-Phase Pair in a Gas-Phase Metal Nitride Anion Ta2N3-. ChemPhysChem 2024, e202400116.