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Jingyun Ye - Publications

Affiliations: 
Clarkson University, Potsdam, NY, United States 
Area:
Computational Chemistry
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37 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Ye J, Li C, Yao X, Jin M, Wan D. Customizing a Hyperbranched Ligand Confers Supported Platinum Nanoclusters with Unexpected Catalytic Activity toward the Reduction of 4-Nitrophenol. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 38038684 DOI: 10.1021/acs.langmuir.3c02884  0.31
2023 Ye J, Ge Q. Metal/metal-oxide interface catalysed thermal and electrochemical CO conversion: a perspective from DFT-based studies. Chemical Communications (Cambridge, England). 59: 8488-8503. PMID 37357561 DOI: 10.1039/d3cc01733h  0.629
2022 Ye J, Truhlar DG. Simple Approximation for the Ideal Reference State of Gases Adsorbed on Solid-State Surfaces. Journal of the American Chemical Society. PMID 35786922 DOI: 10.1021/jacs.2c04333  0.405
2020 Zhu Y, Zheng J, Ye J, Cui Y, Koh K, Kovarik L, Camaioni DM, Fulton JL, Truhlar DG, Neurock M, Cramer CJ, Gutiérrez OY, Lercher JA. Copper-zirconia interfaces in UiO-66 enable selective catalytic hydrogenation of CO to methanol. Nature Communications. 11: 5849. PMID 33208734 DOI: 10.1038/s41467-020-19438-w  0.696
2020 Vollmer MV, Ye J, Linehan JC, Graziano BJ, Preston A, Wiedner ES, Lu CC. Cobalt-Group 13 Complexes Catalyze CO2 Hydrogenation via a Co(−I)/Co(I) Redox Cycle Acs Catalysis. 10: 2459-2470. DOI: 10.1021/Acscatal.9B03534  0.312
2020 Chen L, Ye J, Yang Y, Yin P, Feng H, Chen C, Zhang X, Wei M, Truhlar DG. Catalytic Conversion Furfuryl Alcohol to Tetrahydrofurfuryl Alcohol and 2-Methylfuran at Terrace, Step, and Corner Sites on Ni Acs Catalysis. 10: 7240-7249. DOI: 10.1021/Acscatal.0C01441  0.537
2019 Cammarota RC, Xie J, Burgess SA, Vollmer MV, Vogiatzis KD, Ye J, Linehan JC, Appel AM, Hoffmann C, Wang X, Young VG, Lu CC. Thermodynamic and kinetic studies of H and N binding to bimetallic nickel-group 13 complexes and neutron structure of a Ni(η-H) adduct. Chemical Science. 10: 7029-7042. PMID 31588270 DOI: 10.1039/C9Sc02018G  0.633
2019 Zheng J, Ye J, Ortuño MA, Fulton JL, Gutiérrez OY, Camaioni DM, Motkuri RK, Li Z, Webber TE, Mehdi BL, Browning ND, Penn RL, Farha OK, Hupp JT, Truhlar D, et al. Selective Methane Oxidation to Methanol on Cu-oxo Dimers Stabilized by Zirconia Nodes of NU-1000 Metal-Organic Framework. Journal of the American Chemical Society. PMID 31117650 DOI: 10.1021/Jacs.9B02902  0.702
2019 Otake K, Ye J, Mandal M, Islamoglu T, Buru CT, Hupp JT, Delferro M, Truhlar DG, Cramer CJ, Farha OK. Enhanced Activity of Heterogeneous Pd(II) Catalysts on Acid-Functionalized Metal–Organic Frameworks Acs Catalysis. 9: 5383-5390. DOI: 10.1021/Acscatal.9B01043  0.69
2019 Desai SP, Ye J, Islamoglu T, Farha OK, Lu CC. Mechanistic Study on the Origin of the Trans Selectivity in Alkyne Semihydrogenation by a Heterobimetallic Rhodium–Gallium Catalyst in a Metal–Organic Framework Organometallics. 38: 3466-3473. DOI: 10.1021/Acs.Organomet.9B00331  0.505
2018 Desai SP, Ye J, Zheng J, Ferrandon MS, Webber TE, Platero-Prats AE, Duan J, Garcia-Holley P, Camaioni DM, Chapman KW, Delferro M, Farha OK, Fulton JL, Gagliardi L, Lercher JA, et al. Well-Defined Rh-Ga Catalytic Sites in a Metal-Organic Framework: Promoter-Controlled Selectivity in Alkyne Semi-Hydrogenation to E-Alkenes. Journal of the American Chemical Society. PMID 30352506 DOI: 10.1021/Jacs.8B08550  0.591
2018 Liu J, Ye J, Li Z, Otake KI, Liao Y, Peters AW, Noh H, Truhlar DG, Gagliardi L, Cramer CJ, Farha OK, Hupp JT. Beyond the Active Site: Tuning the Activity and Selectivity of a Metal-Organic Framework-Supported Ni Catalyst for Ethylene Dimerization. Journal of the American Chemical Society. PMID 30141922 DOI: 10.1021/Jacs.8B06006  0.751
2018 Ye J, Li L, Johnson JK. The effect of topology in Lewis pair functionalized metal organic frameworks on CO2 adsorption and hydrogenation Catalysis Science & Technology. 8: 4609-4617. DOI: 10.1039/C8Cy01018H  0.5
2018 Ye J, Cammarota RC, Xie J, Vollmer MV, Truhlar DG, Cramer CJ, Lu CC, Gagliardi L. Rationalizing the Reactivity of Bimetallic Molecular Catalysts for CO2 Hydrogenation Acs Catalysis. 8: 4955-4968. DOI: 10.1021/Acscatal.8B00803  0.755
2018 Ye J, Cramer CJ, Truhlar DG. Organic Linker Effect on the Growth and Diffusion of Cu Clusters in a Metal–Organic Framework The Journal of Physical Chemistry C. 122: 26987-26997. DOI: 10.1021/Acs.Jpcc.8B09178  0.681
2018 Ye J, Gagliardi L, Cramer CJ, Truhlar DG. Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization Journal of Catalysis. 360: 160-167. DOI: 10.1016/J.Jcat.2017.12.007  0.755
2017 Cammarota RC, Vollmer MV, Xie J, Ye J, Linehan JC, Burgess SA, Appel AM, Gagliardi L, Lu CC. A bimetallic nickel-gallium complex catalyzes CO2 hydrogenation via the intermediacy of an anionic d(10) nickel hydride. Journal of the American Chemical Society. PMID 28898066 DOI: 10.1021/Jacs.7B07911  0.667
2017 Platero-Prats AE, League AB, Bernales V, Ye J, Gallington LC, Vjunov A, Schweitzer NM, Li Z, Zheng J, Mehdi BL, Stevens AJ, Dohnalkova A, Balasubramanian M, Farha OK, Hupp JT, et al. Bridging Zirconia Nodes within a Metal-Organic Framework via Catalytic Ni-hydroxo Clusters to Form Hetero-Bimetallic Nanowires. Journal of the American Chemical Society. PMID 28696712 DOI: 10.1021/Jacs.7B04997  0.737
2017 Ye J, Yeh BY, Reynolds RA, Johnson JK. Screening the activity of Lewis pairs for hydrogenation of CO2 Molecular Simulation. 43: 821-827. DOI: 10.1080/08927022.2017.1295457  0.486
2017 Austin N, Ye J, Mpourmpakis G. CO2 activation on Cu-based Zr-decorated nanoparticles Catalysis Science & Technology. 7: 2245-2251. DOI: 10.1039/C6Cy02628A  0.389
2017 Ye J, Gagliardi L, Cramer CJ, Truhlar DG. Single Ni atoms and Ni4 clusters have similar catalytic activity for ethylene dimerization Journal of Catalysis. 354: 278-286. DOI: 10.1016/J.Jcat.2017.08.011  0.74
2017 Rui N, Wang Z, Sun K, Ye J, Ge Q, Liu Cj. CO2 hydrogenation to methanol over Pd/In2O3: effects of Pd and oxygen vacancy Applied Catalysis B-Environmental. 218: 488-497. DOI: 10.1016/J.Apcatb.2017.06.069  0.589
2016 Ye J, Johnson JK. Catalytic hydrogenation of CO2 to methanol in a Lewis pair functionalized MOF Catalysis Science & Technology. 6: 8392-8405. DOI: 10.1039/C6Cy01245K  0.449
2015 Ye J, Johnson JK. Screening Lewis Pair Moieties for Catalytic Hydrogenation of CO2 in Functionalized UiO-66 Acs Catalysis. 5: 6219-6229. DOI: 10.1021/Acscatal.5B01191  0.501
2015 Ye J, Johnson JK. Design of Lewis Pair-Functionalized Metal Organic Frameworks for CO<inf>2</inf> Hydrogenation Acs Catalysis. 5: 2921-2928. DOI: 10.1021/Acscatal.5B00396  0.549
2015 Sun K, Fan Z, Ye J, Yan J, Ge Q, Li Y, He W, Yang W, Liu CJ. Hydrogenation of CO2 to methanol over In2O3 catalyst Journal of Co2 Utilization. 12: 1-6. DOI: 10.1016/J.Jcou.2015.09.002  0.615
2015 Ye J, Ge Q, Liu CJ. Effect of PdIn bimetallic particle formation on CO2 reduction over the Pd–In/SiO2 catalyst Chemical Engineering Science. 135: 193-201. DOI: 10.1016/J.Ces.2015.04.034  0.657
2014 Ye J, Liu CJ, Mei D, Ge Q. Methanol synthesis from CO2 hydrogenation over a Pd4/In2O3 model catalyst: A combined DFT and kinetic study Journal of Catalysis. 317: 44-53. DOI: 10.1016/J.Jcat.2014.06.002  0.62
2014 Sun Q, Ye J, Liu CJ, Ge Q. In 2 O 3 as a promising catalyst for CO 2 utilization: A case study with reverse water gas shift over In 2 O 3 Greenhouse Gases-Science and Technology. 4: 140-144. DOI: 10.1002/Ghg.1401  0.573
2013 Xia Y, Ye J, Murray P, Ali A, Ge Q, Zhang Z. Imaging reactions of acetone with oxygen adatoms on partially oxidized TiO2(110). Physical Chemistry Chemical Physics : Pccp. 15: 13897-901. PMID 23842844 DOI: 10.1039/C3Cp51695D  0.545
2013 Ye J, Liu C, Mei D, Ge Q. Active Oxygen Vacancy Site for Methanol Synthesis from CO2 Hydrogenation on In2O3(110): A DFT Study Acs Catalysis. 3: 1296-1306. DOI: 10.1021/Cs400132A  0.587
2012 Xia Y, Zhang B, Ye J, Ge Q, Zhang Z. Acetone-Assisted Oxygen Vacancy Diffusion on TiO2(110). The Journal of Physical Chemistry Letters. 3: 2970-4. PMID 26292235 DOI: 10.1021/Jz301293Y  0.551
2012 Ye J, Liu C, Ge Q. A DFT study of methanol dehydrogenation on the PdIn(110) surface. Physical Chemistry Chemical Physics : Pccp. 14: 16660-7. PMID 23069911 DOI: 10.1039/C2Cp42183F  0.562
2012 Lin CK, Zhao D, Gao WY, Yang Z, Ye J, Xu T, Ge Q, Ma S, Liu DJ. Tunability of band gaps in metal-organic frameworks. Inorganic Chemistry. 51: 9039-44. PMID 22838388 DOI: 10.1021/Ic301189M  0.561
2012 Ye J, Liu C, Ge Q. DFT Study of CO2 Adsorption and Hydrogenation on the In2O3 Surface Journal of Physical Chemistry C. 116: 7817-7825. DOI: 10.1021/Jp3004773  0.594
2011 Liu C, Ye J, Jiang J, Pan Y. ChemInform Abstract: Progresses in the Preparation of Coke Resistant Ni-Based Catalyst for Steam and CO2 Reforming of Methane Cheminform. 42: no-no. DOI: 10.1002/CHIN.201127237  0.333
2011 Liu C, Ye J, Jiang J, Pan Y. Progresses in the Preparation of Coke Resistant Ni-based Catalyst for Steam and CO2 Reforming of Methane Chemcatchem. 3: 529-541. DOI: 10.1002/Cctc.201000358  0.467
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