2025年发表论文

(1) Zhao, A.; *Zhao, Y.-X.; Li, Q.; Zhao, X.-G.; Liu, Q.-Y.; *He, S.-G. Selective Production of Acetylene from the C─C Coupling Reaction of CH₄ with CO₂ Mediated by Ta₂O₂⁺ Cluster Cations. Angew. Chem. Int. Ed. 2025, 64 (32), e202503132. DOI: 10.1002/anie.202503132.

(2) Mou, L.-H.; Jiang, G.-D.; Wang, C.; Cheng, X.; *Yu, J.; *Li, Z.-Y.; *Jiang, J. Unveiling Universal Reactivity Descriptors of Metal Clusters toward Dinitrogen Activation: A Machine Learning Protocol with Three-Level Feature Extraction. ACS Catalysis 2025, 15 (8), 6618-6627. DOI: 10.1021/acscatal.5c01379.

(3) Liu, X.-X.; *Li, Z.-Y.; Zhao, X.-G.; Liu, Q.-Y.; Zhao, Z.-P.; *He, S.-G. Generation of the NCN Radical from Co-Conversion of N₂ and CO₂ Mediated by the Niobium Oxide Cluster Anion Nb₂O₃^–. Angew. Chem. Int. Ed., e19854. DOI: 10.1002/anie.202519854.

(4) Zhao, A.; *Liu, Q.-Y.; Zhao, Z.-P.; Li, Z.-Y.; *He, S.-G. Coupling of a High-Temperature Ion Trap Reactor with an Electron-Spray-Ionization Source for Reactions of Mass-Selected Organometallic Ions. Chin. J. Chem. Phys. 2025, 1-12. DOI: 10.1063/1674-0068/cjcp2507097.

(5) Wang, S.-D.; Liu, Y.; *Ma, T.-M.; *Li, X.-N.; *He, S.-G. Factors Determining the Selectivity of NO Reduction Catalyzed by Copper-Vanadium Oxide Cluster Anions Cu₂VO₃₋₅⁻. ChemPhysChem 2025, 26 (2), e202400888. DOI: 10.1002/cphc.202400888.

(6) Xu, Y.; *Li, Z.-Y.; Xiao, Y.-T.; Hu, Y.-Z.; Yang, Q.; Wu, X.-N.; *He, S.-G. Machine Learning Study of Methane Activation by O-Centered Radicals over Metal Oxide Clusters. ChemPhysChem 2025, 26 (20), e202500274. DOI: 10.1002/cphc.202500274.

(7) Li, X.-W.; Zhang, F.-X.; Zhao, X.-G.; Liu, Q.-Y.; He, S.-G.; *Ma, J.-B. Dinitrogen Activation and Cyanide Release by the Gas-Phase Cluster Anions InNbC₂^–: Synergistic Effects of the p-Block Indium and the d-Block Niobium. J. Am. Chem. Soc. 2025, 147 (25), 22185-22191. DOI: 10.1021/jacs.5c06920.

(8) Xiao, Y.-T.; *Zhao, Y.-X.; Hu, Y.-Z.; Zhao, A.; Liu, Q.-Y.; *He, S.-G. Formyl Radical Generation from Methane Oxidation Promoted by the Superoxide Radical in Tungsten Oxide Cations WO₄⁺. J. Am. Chem. Soc. 2025, 147 (30), 26109-26115. DOI: 10.1021/jacs.5c08637.

(9) Yang, Y.; Zhang, L.-J.; Wang, X.-L.; Wang, R.; *Zhao, Y.-X.; *He, S.-G.; *Zang, S.-Q. Consecutive C–C Coupling of CH₄ and CO₂ Mediated by Heteronuclear Metal Cations CuTa⁺. J. Am. Chem. Soc. 2025, 147 (1), 362-371. DOI: 10.1021/jacs.4c10819.

(10) Li, Q.; Liu, Q.-Y.; Zhao, A.; *He, S.-G. Reactions between TaxOy− (x = 1–5, y = 0–7) cluster anions and C1–C3 alkanes. J. Chem. Phys. 2025, 163 (5), 054303. DOI: 10.1063/5.0278938.

(11) Xu, Y.; *Li, Z.-Y.; Yang, Q.; Zhao, X.-G.; Li, Q.; *He, S.-G. Machine Learning Study of Methane Activation by Gas-Phase Species. J. Phys. Chem. A 2025, 129 (8), 1941-1951. DOI: 10.1021/acs.jpca.4c06602.

(12) Hui, R.-Z.; Zhang, L.-J.; Hou, G.-L.; He, S.-G.; *Li, Y.-K. Thermal CO₂ Adsorption and Activation on Copper Oxide Cluster Anions Cu_nO^– (n = 3–9). J. Phys. Chem. A 2025, 129 (37), 8622-8629. DOI: 10.1021/acs.jpca.5c05605.

(13) Liu, Y.; He, S.-G.; *Li, X.-N. Dual Conflicting Roles of Preattached CO in the Water–Gas Shift Reaction Mediated by Iridium–Vanadium Oxide Clusters IrV₂O_3,4CO^–. J. Phys. Chem. Lett. 2025, 16 (45), 11649-11656. DOI: 10.1021/acs.jpclett.5c02987.

(14) Zhao, X.-G.; Li, Q.; *Zhao, Y.-X.; *He, S.-G. Partial Oxidation of Methane with Molecular Oxygen to Produce Hydrogen Catalyzed by Rh₃O₂⁺ Clusters. J. Phys. Chem. Lett. 2025, 16 (48), 12437-12444. DOI: 10.1021/acs.jpclett.5c03184.

(15) Wang, S.-D.#; Sun, X.-Y.#; Wang, Z.-H.; *Ma, T.-M.; He, S.-G.; *Li, X.-N. A Single Copper–Vanadium Oxide Cluster Cu₃VO₃^– Reduces Four NO Molecules with the Accomplishment of a Catalytic Cycle by CO. J. Phys. Chem. Lett. 2025. DOI: 10.1021/acs.jpclett.5c03457.

(16) *Chen, J.-J.; Zhao, X.-G.; Zang, B.-H.; Jia, H.-R.; Liu, Q.-Y.; Ding, X.-L.; *He, S.-G. C60-Supported Single Pt Atom for Selective CH4 Activation. J. Phys. Chem. Lett. 2025, 16 (25), 6463-6469. DOI: 10.1021/acs.jpclett.5c01340.

(17) Wang, X.-L.; Zhang, L.-J.; Qi, J.-Y.; Dong, X.; *Chen, J.-J.; *Zhao, Y.-X.; *Yang, Y. Copper Tuning the Reactivity of Bimetallic Cluster Anions Cu_nTa₂^– (n = 0–4) toward Methane. J. Phys. Chem. Lett. 2025, 16 (27), 7020-7027. DOI: 10.1021/acs.jpclett.5c01292.

(18) Yuan, R.-N.; *Chen, Q.; Niu, H.; Gao, C.-Y.; Zhao, X.-N.; Wu, Y.-B.; *He, S.-G.; *Li, S.-D. Observation of boron carbonyl complexes B₁₁(CO)_n⁺ (n = 1–6) and B₁₅(CO)_n⁺ (n = 1–5) with conflicting aromaticity. Phys. Chem. Chem. Phys. 2025, 27 (14), 7279-7287. DOI: 10.1039/D5CP00755K.