Dr. Yu, Jen-Shiang K.   

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Selected Publication

  1. Gou-Tao Huang, and Jen-Shiang K. Yu*, Catalytic Role of the Enol Ether Intermediate in the Intramolecular Stetter Reaction: A Computational Perspective, Phys. Chem. Chem. Phys., 26 11833-11853 (2024). [3.3] DOI: 10.1039/D3CP06051A
  2. Gou-Tao Huang, Ming-Hsiu Hsieh, and Jen-Shiang K. Yu*, Formation of Breslow Intermediates under Aprotic Conditions: A Computational Study, J. Org. Chem., 87 2501-2507 (2022). [4.805] DOI: 10.1021/acs.joc.1c02408
  3. Ming-Hsiu Hsieh, and Jen-Shiang K. Yu*, Fragmentation and rearrangement of Breslow intermediates: branches to both of radical and ionic pathways, Phys. Chem. Chem. Phys., 23 27377-27384 (2021). [3.676] DOI: 10.1039/D1CP03118J
  4. Ming-Hsiu Hsieh, Gou-Tao Huang, and Jen-Shiang K. Yu*, Dipole-bound states and substituent effects of Breslow intermediates in the enolate form, J. Chin. Chem. Soc., 68 2060-2070 (2021). [1.967] DOI: 10.1002/jccs.202100310
  5. Warinthon Chansen, Jen-Shiang K.Yu* and Nawee Kungwan*, A TD-DFT molecular screening for fluorescence probe based on excited-state intramolecular proton transfer of 2'-hydroxychalcone derivatives, J. Photochem. Photobiol. A, 410 113165 (2021). [3.306] DOI: 10.1016/j.jphotochem.2021.113165
  6. Yi-Ju Yua, Tzung-Wen Chiou, Jen-Shiang K.Yu* and Li-Kang Chu*, Time-resolved Infrared Characterization on the Photolysis of Roussin's Red Phenyl Ester in Different Solvents, J. Photochem. Photobiol. A, 406 113032 (2021). [3.306] DOI: 10.1016/j.jphotochem.2020.113032
  7. Gou-Tao Huang and Jen-Shiang K. Yu*, Analyses on Molecular Properties of the Diamidinate CrI—CrI Complex by Multireference and DFT Approaches, J. Phys. Chem. A, 123 7803-7813 (2019). [2.836] DOI: 10.1021/acs.jpca.9b04423
  8. Ming-Hsiu Hsieh, Gou-Tao Huang* and Jen-Shiang K. Yu*, Can the Radical Channel Contribute to the Catalytic Cycle of N-Heterocyclic Carbene in Benzoin Condensation?, J. Org. Chem., 83 15202-15209 (2018). [4.805] DOI: 10.1021/acs.joc.8b02483
  9. Gou-Tao Huang and Jen-Shiang K. Yu*, Catalytic Roles of Histidine and Arginine in Pyruvate Class II Aldolase: A Perspective from QM/MM Metadynamics, ACS Catal., 7 8130-8133 (2017). [10.614] DOI: 10.1021/acscatal.7b03398
  10. Yu-Siang Huang, Gou-Tao Huang, Yao-Lun Liu, Jen-Shiang K. Yu* and Yi-Chou Tsai*, Reversible Cleavage/Formation of the Cr-Cr Quintuple Bond in the Highly Regioselective Alkyne Cyclotrimerization, Angew. Chem. Int. Edit., 56 15427-15431 (2017). [11.994] DOI: 10.1002/anie.201709583
  11. Gou-Tao Huang and Jen-Shiang K. Yu* Enzyme Catalysis that Paves the Way for S-Sulfhydration via Sulfur Atom Transfer, J. Phys. Chem. B, 120 4608-4615 (2016). [3.302] DOI: 10.1021/acs.jpcb.6b0338
  12. Kuan-Yu Liu and Jen-Shiang K. Yu* Electronic Structure of Open-Shell Tetrahedral {Fe(NO)2}9 Dinitrosyliron Complexes, Inorg. Chem., 53 10785-10787 (2014). [4.794] DOI: 10.1021/ic501116t
  13. Zong-Sian Lin, Tzung-Wen Chiou, Kuan-Yu Liu, Chang-Chih Hsieh, Jen-Shiang K. Yu* and Wen-Feng Liaw*, A Dinitrosyliron Complex within the Homoleptic Fe(NO)4 Anion: NO as Nitroxyl and Nitrosyl Ligands within a Single Structure, Inorg. Chem., 51, 10092-10094 (2012). [4.601] DOI: 10.1021/ic3018437
    Highlight by C&EN Volume 90 Issue 39 p.31, September 24, 2012.
  14. H.-Z. Chen, S.-C. Liu, C.-H. Yen, J.-S. K. Yu*, Y.-J. Shieh, T.-S. Kuo and Y.-C. Tsai*, Reactions of Metal–Metal Quintuple Bonds with Alkynes: [2+2+2] and [2+2] Cycloadditions, Angew. Chem. Int. Edit., 51, 10342-10346 (2012). [12.730] DOI: 10.1002/anie.201205027
  15. Y.-L. Huang, D.-Y. Lu, H.-C. Yu, J.-S. K. Yu, T.-S. Kuo, G.-H. Lee, Y. Wang, and Y.-C. Tsai, Stepwise Construction of the Cr-Cr Quintuple Bond and Its Destruction upon Axial Coordination, Angew. Chem. Int. Edit., 51, 7781-7785 (2012). [12.730] DOI: 10.1002/anie.201202337
  16. I.-Y. Chang, and J.-S. K. Yu*, A Theoretical Revisit to the Lowest Ionization Potentials in Metal-Metal Bonds, Chem. Eur. J., 18, 9189-9193 (2012). [5.476] DOI: 10.1002/chem.201200731
  17. S.-C. Liu, W.-L. Ke, J.-S. K. Yu*, T.-S. Kuo, and Y.-C. Tsai*, An Electron-Rich Molybdenum –Molybdenum Quintuple Bond Spanned by One Lithium Atom, Angew. Chem. Int. Edit., 51, 6394-6397 (2012). [12.730] DOI: 10.1002/anie.201200122
  18. D.-Y. Lu, J.-S. K. Yu, T.-S. Kuo, G.-H Lee, Y. Wang, and Y.-C. Tsai, Theory-Guided Experiments on the Mechanistic Elucidation of the Reduction of Dinuclear Zinc, Manganese, and Cadmium Complexes, Angew. Chem. Int. Edit., 50, 7611-7615 (2011). [12.730] DOI: 10.1002/anie.201102296
  19. Y.-C. Tsai, H.-Z. Chen, C.-C Chang, J.-S. K. Yu, G.-H. Lee, Y. Wang and T.-S. Kuo, Journey from Mo-Mo Quadruple Bonds to Quintuple Bonds, J. Am. Chem. Soc., 131, 12534-12535 (2009). [8.091] DOI: 10.1021/ja905035f
  20. C.-W. Hsu, J.-S. K. Yu, C.-H. Yen, G.-H. Lee, Y. Wang and Y.-C. Tsai, Quintuply-Bonded Dichromium(I) Complexes Featuring Metal-Metal Bond Lengths of 1.74 Å, Angew. Chem. Int. Edit., 47, 9933-9936 (2008). [10.031] DOI: 10.1002/anie.200803859
  21. Y.-C. Tsai, C.-W. Hsu, J.-S. K. Yu, G.-H. Lee, Y. Wang and T.-S. Kuo, Remarkably Short Metal-Metal Bonds: A Lantern-Type of Quintuply-Bonded Dichromium(I) Complex, Angew. Chem. Int. Edit., 47, 7250-7253 (2008). [10.031] DOI: 10.1002/anie.200801286
    Introduced as Research Highlights in Nature Chemistry, and in Nature News in August 2008. Also appeared as Editor's Choice in Science, issue 29 August 2008.
  22. Y.-C. Tsai, D.-Y. Lu, Y.-M. Lin, J.-K. Hwang and J.-S. K. Yu, Structural Transformations in Dinuclear Zinc Complexes Involving Zn-Zn Bonds, Chem. Commun., 4125-4127 (2007). [5.141] DOI: 10.1039/b707396h
  23. Y.-C. Tsai, Y.-M. Lin, J.-S. K. Yu and J.-K. Hwang, A Three-Coordinate and Quadruply Bonded Mo-Mo Complex, J. Am. Chem. Soc., 128, 13980-13981 (2006). [7.696] DOI: 10.1021/ja0635884
  24. J.-S. K. Yu and C.-H. Yu, Reply to "Comment on 'Time-Dependent Density Functional Study of Electroluminescent Polymers'", J. Chem. Phys. A., 108, 9318 (2004). [2.639] DOI: 10.1021/jp040319w
  25. J.-S. K. Yu, J.-K. Hwang, C. Y. Tang and C.-H. Yu, Numerical Performance and Throughput Benchmark for Electronic Structure Calculations in PC-Linux Systems with New Architectures, Updated Compilers and Libraries, J. Chem. Inf. Comput. Sci., 44, 635-642 (2004). [2.810] DOI: 10.1021/ci034210h
  26. C.-H. Yu, J.-S. K. Yu and W.-C. Chen, The Estimations of Inner-Shell Ionization Energies for Alkyl Halides: A Designated Single-Configuration CASSCF Approach and Advanced Correction, J. Theor. Comput. Chem., 3, 103-115 (2004). [1.085(2005)] DOI: 10.1142/S021963360400088X [supporting information]
  27. J.-S. K. Yu, W.-C. Chen and C.-H. Yu, Time-Dependent Density Functional Study of Electroluminescent Polymers, J. Phys. Chem. A., 107, 4268-4275 (2003). [2.792] DOI: 10.1021/jp026461j
  28. J.-S. K. Yu, S.-Y. Chen and C.-H. Yu, Analytical Fittings for the Global Potential Energy Surface of the Ground State of Methylene, J. Chem. Phys., 118, 582-594 (2003). [2.950] DOI: 10.1063/1.1523906
  29. J.-S. K. Yu and C.-h. Yu, Recent Advances in PC-Linux Systems for Electronic Structure Computations by Optimized Compilers and Numerical Libraries, J. Chem. Inf. Comput. Sci., 42, 673-681 (2002). [2.902] DOI: 10.1021/ci010345g
  30. B.-M. Cheng, E. P. Chew, J.-S. K. Yu, and C.-h. Yu, Photoionization study of CH3SCH2Cl formed in the reaction system Cl/Cl2/CH3SCH3, J. Chem. Phys., 114, 4817-4823, (2001). [3.147] DOI: 10.1063/1.1349078
  31. S.-Y. Chiang, T.-T. Wang, J.-S. K. Yu, and C.-h. Yu, Valence Ionic States and Dissociative Photoionization of CH3CFCl2 with Synchrotron Radiation, Chem. Phys. Lett., 329, 185-190, (2000). [2.364] DOI: 10.1016/S0009-2614(00)01019-8 Write an email to me and I would be happy to provide a reprint!
  32. B.-M. Cheng, E. P. Chew, C.-P. Liu, J.-S. K. Yu, and C.-h. Yu, Photoionization-efficiency spectrum and ionization energy of C2H5SCl, J. Chem. Phys., 111, 10093-10098, (1999). [3.289] DOI: 10.1063/1.480360
  33. B.-M. Cheng, E. P. Chew, C.-P. Liu, J.-S. K. Yu, and C.-h. Yu, Photoionization Spectrum and Ionization Energies of CH3SCl, J. Chem. Phys., 110, 4757-4762, (1999). [3.289] DOI: 10.1063/1.478362
  34. J.-S. K. Yu and C.-h. Yu, Benchmarks of PC-UNIX Computers with Electronic Structure Calculation, J. Chem. Inf. Comput. Sci., 37, 1111-1114, (1997). [2.073] DOI: 10.1021/ci970284f
  35. J.-S. K. Yu and C.-h. Yu, Ab Initio Study of the Decomposition of Formaldehyde, Chem. Phys. Lett., 271, 259-265, (1997). [2.441] DOI: 10.1016/S0009-2614(97)00456-9 Write an email to me and I would be happy to provide a reprint!

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Last updated: Nov. 03, 2024