Published in Nanoscale, 2023
First principles molecular dynamics reveals how different types of defects on the Ti3C2Tx MXene surface influence its interaction with water.
Recommended citation: Song, H.; Jiang, D.-e., First principles insights into stability of defected MXenes in water. Nanoscale, 2023, 15, 16010 - 16015. https://pubs.rsc.org/en/content/articlepdf/2023/nr/d3nr02538a
Published in Chemical Science, 2023
As explained by density functional theory calculations, this site opened a new path via a dicarbonyl intermediate for CO oxidation with a greatly reduced energy barrier. These results provide guidance for rationally improving the catalytic properties of SA sites for oxidation reactions
Recommended citation: Li, Y.; Wang, H.; Song, H.; Rui, N.; Kottwitz, M.; Senanayake, S. D.; Nuzzo, R.; Wu, Z.; Jiang, D.-e.; Frenkel, A. I., Active Site of Atomically Dispersed Pt Supported on Gd-Doped Ceria with Improved Low Temperature Performance for CO Oxidation. Chemical Science 2023. DOI: 10.1039/D3SC03988A https://pubs.rsc.org/en/Content/ArticleLanding/2023/SC/D3SC03988A
Published in Nature Communications, 2024
Tuning metal-support interactions in nickel–zeolite catalysts leads to enhanced stability during dry reforming of methane
Recommended citation: Zhang, J.; Li, Y.; Song, H.; Zhang, L.; Wu, Y.; He, Y.; Ma, L.; Hong, J.; Tayal, A.; Marinkovic, N.; Jiang, D. E.; Li, Z.; Wu, Z.; Polo-Garzon, F., Tuning metal-support interactions in nickel-zeolite catalysts leads to enhanced stability during dry reforming of methane. Nat Commun 2024, 15 (1), 8566. https://www.nature.com/articles/s41467-024-50729-8
Published in Journal of the American Chemical Society, 2024
Oxide Acidity Modulates Structural Transformations in Hydrogen Titanates during Electrochemical Li-Ion Insertion
Recommended citation: Saeed, S.; Fleischmann, S.; Kobayashi, T.; Jusys, Z.; Mamontov, E.; Osti, N. C.; Holzapfel, N. P.; Song, H.; Wang, T.; Dai, S.; Jiang, D.-e.; Augustyn, V., Oxide Acidity Modulates Structural Transformations in Hydrogen Titanates during Electrochemical Li-Ion Insertion. Journal of the American Chemical Society 2024, 146 (42), 28795-28808. https://pubs.acs.org/doi/full/10.1021/jacs.4c08063
Published in ACS Catalysis, 2024
Active Palladium Structures on Ceria Obtained by Tuning Pd–Pd Distance for Efficient Methane Combustion
Recommended citation: Yang, W.#; Song, H.#; Zhang, L.; Zhang, J.; Polo-Garzon, F.; Wang, H.; Meyer, H.; Jiang, D.-e.; Wu, Z.; Li, Y., Active Palladium Structures on Ceria Obtained by Tuning Pd–Pd Distance for Efficient Methane Combustion. ACS Catalysis 2024, 16459-16468. https://pubs.acs.org/doi/full/10.1021/acscatal.4c04985
Published in Nanoscale, 2024
Electronic and geometric effects in Au@ NiO core–shell nanocatalyst on oxidative esterification of aldehyde
Recommended citation: Zhan, S.;Song, H.; Wu,Z.;Jiang, D.-e., Electronic and geometric effects in Au@ NiO core–shell nanocatalyst on oxidative esterification of aldehyde. Nanoscale, 2025, DOI: 10.1039/D4NR03302G. https://pubs.rsc.org/en/content/articlehtml/2024/nr/d4nr03302g
Published in Small Science, 2024
Highly Selective Methanol Synthesis Using Electrochemical CO2 Reduction with Defect-Engineered Cu58 Nanoclusters
Recommended citation: Biswas, S.; Tanaka, T.; Song, H.; Ogami, M.; Shingyouchi, Y.; Hossian, S.; Kamiyama, M.; Kosaka, T.; Nakatani, R.; Niihori, Y.; Das, S.; Kawawaki, T.; Jiang, D. e.; Negishi, Y., Highly Selective Methanol Synthesis Using Electrochemical CO2 Reduction with Defect‐Engineered Cu58 Nanoclusters. Small Science 2024. https://onlinelibrary.wiley.com/doi/full/10.1002/smsc.202400465
Published in Angewandte Chemie, 2025
Nanoconfinement-induced electrochemical ion-solvent cointercalation in pillared titanate host materials.
Recommended citation: Elmanzalawy M; Song H; Tobis M; Leiter R; Choi J, Moon H et al. Nanoconfinement-induced electrochemical ion-solvent cointercalation in pillared titanate host materials. Angewandte Chemie 2025,10.1002/anie.202423593. https://onlinelibrary.wiley.com/doi/full/10.1002/anie.202423593
Published in Journal of the American Chemical Society, 2025
Atomically Precise [Cu23H4(SC7H7)18(PPh3)6] Nanocluster: Structural Integration of Johnson Solids through a Cu(0) Center and Electrocatalytic Functionality.
Recommended citation: Biswas, S.; Shingyouchi, Y.;Kamiyama M.;Ogami M.; Song, H.; etc. Atomically Precise [Cu23H4(SC7H7)18(PPh3)6] Nanocluster: Structural Integration of Johnson Solids through a Cu(0) Center and Electrocatalytic Functionality. Journal of the American Chemical Society 2025, 147 (27), 23733-23742. https://pubs.acs.org/doi/full/10.1021/jacs.5c05665
Published in Catalysis Science & Technology, 2025
Computational insights into hydrogen adsorption energies on medium-entropy oxides
Recommended citation: Song, H.; Jiang, D.-e. Computational insights into hydrogen adsorption energies on a medium-entropy oxides. Catal. Sci. Technol. 2025, 10.1039/D5CY00583C. https://pubs.rsc.org/en/content/articlelanding/2025/cy/d5cy00583c
Published in The Journal of Physical Chemistry Letters, 2025
Breaking the Brønsted–Evans–Polanyi Relation with Dual-Metal Sites
Recommended citation: Chen, Y.; Song, H.; Wu, Z.; Jiang, D. E.,Breaking the Brønsted–Evans–Polanyi Relation with Dual-Metal Sites. The Journal of Phys. Chem. Letters.16, 11302-11307 https://pubs.acs.org/doi/full/10.1021/acs.jpclett.5c02446
Published in Nature Communications , 2025
Selective semihydrogenation of acetylene in ethylene using defect-rich boron nitride catalyst from flux reconstruction
Recommended citation: Wang, T. etc.Selective semihydrogenation of acetylene in ethylene using defect-rich boron nitride catalyst from flux reconstruction.Nat Commun. 2025, 16(1),9948 https://www.nature.com/articles/s41467-025-64886-x
Published in ACS Catalysis, 2025
Dynamic Features of Cu-Ceria Interface under CO2 Hydrogenation to Methanol
Recommended citation: Li, Y.; Chen, Y.; Song, H.etc. Dynamic Features of Cu-Ceria Interface under CO2 Hydrogenation to Methanol. ACS Catal. 2026, 16 (2), 1132–1143. https://doi.org/10.1021/acscatal.5c06321. https://pubs.acs.org/doi/abs/10.1021/acscatal.5c06321
Published:
First principles insights into stability of defected MXenes in water
Published:
First principles insights into stability of defected MXenes in water
Published:
Active Site of Pt Single-Atom Supported on Gd-Doped Ceria with Improved Low Temperature Performance for CO Oxidation - DFT insights
Published:
Computational Insights into Ceria-Supported Single and Dual Atom Catalysts
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Tuning Pd-Pd atomic distance on Ceria for Efficient CH4 Combustion –DFT Insights
Published:
Predicting Hydrogen Adsorption Energies on High-Entropy Oxides Using Machine Learning
Published:
Predicting Hydrogen Adsorption Energies on High-Entropy Oxides Using Machine Learning
TA for lab, University of California, Riverside, Chemistry, 2020
Chem 01A lab for undergraduated student
TA for lab, University of California, Riverside, Chemistry, 2021
Chem 01C lab for undergraduated student