Beyond exciton theory: a time-dependent DFT and Franck− Condon study of perylene diimide and its chromophoric dimer AE Clark, C Qin, ADQ Li Journal of the American Chemical Society 129 (24), 7586-7595, 2007 | 191 | 2007 |
DFT characterization of the optical and redox properties of natural pigments relevant to dye-sensitized solar cells C Qin, AE Clark Chemical physics letters 438 (1-3), 26-30, 2007 | 182 | 2007 |
Mechanisms of water oxidation catalyzed by ruthenium diimine complexes JK Hurst, JL Cape, AE Clark, S Das, C Qin Inorganic chemistry 47 (6), 1753-1764, 2008 | 163 | 2008 |
Unraveling the role of structural water in bilayer V 2 O 5 during Zn 2+-intercalation: insights from DFT calculations T Wu, K Zhu, C Qin, K Huang Journal of materials chemistry A 7 (10), 5612-5620, 2019 | 146 | 2019 |
Adsorption of O, H, OH, and H2O on Ag(100) C Qin, JL Whitten The Journal of Physical Chemistry B 109 (18), 8852-8856, 2005 | 52 | 2005 |
First spectroscopic identification of pyrocarbonate for high CO 2 flux membranes containing highly interconnected three dimensional ionic channels L Zhang, X Huang, C Qin, K Brinkman, Y Gong, S Wang, K Huang Physical Chemistry Chemical Physics 15 (31), 13147-13152, 2013 | 43 | 2013 |
Can silver be a reliable current collector for electrochemical tests? Y Gong, C Qin, K Huang ECS Electrochemistry Letters 2 (1), F4, 2012 | 32 | 2012 |
Interaction of S, SH and H2S with Ag (1 0 0) C Qin, JL Whitten Surface science 588 (1-3), 83-91, 2005 | 28 | 2005 |
CO adsorption on Ag (100) and Ag/MgO (100) C Qin, LS Sremaniak, JL Whitten The Journal of Physical Chemistry B 110 (23), 11272-11276, 2006 | 27 | 2006 |
CO oxidation by molecular and atomic oxygen on Ag (100): a density functional theory study X Lei, G Mbamalu, C Qin The Journal of Physical Chemistry C 121 (5), 2635-2642, 2017 | 25 | 2017 |
DFT study of CO42-and CO52-relevant to oxygen reduction with the presence of molten carbonate in solid oxide fuel cells C Qin, A Gladney Computational and Theoretical Chemistry 999, 179-183, 2012 | 23 | 2012 |
Molten carbonates as an effective oxygen reduction catalyst for 550–650° C solid oxide fuel cells Y Gong, X Li, L Zhang, W Tharp, C Qin, K Huang Journal of The Electrochemical Society 160 (9), F958, 2013 | 22 | 2013 |
Promoting electrocatalytic activity of a composite SOFC cathode La0. 8Sr0. 2MnO3+ δ/Ce0. 8Gd0. 2O2-δ with molten carbonates Y Gong, X Li, L Zhang, W Tharp, C Qin, K Huang Journal of The Electrochemical Society 161 (3), F226, 2013 | 17 | 2013 |
Density functional theory study of oxygen migration in molten carbonate X Lei, K Haines, K Huang, C Qin Journal of Power Sources 305, 161-166, 2016 | 15 | 2016 |
CI Study of CO adsorption on MgO (1 0 0) C Qin Chemical Physics Letters 460 (4-6), 457-460, 2008 | 14 | 2008 |
DFT study of oxygen dissociation in molten carbonate X Lei, K Haines, K Huang, C Qin The Journal of Physical Chemistry A 119 (33), 8806-8812, 2015 | 13 | 2015 |
Thermal Isomerization of Tricyclo[4.1.0.02,7]heptane and Bicyclo[3.2.0]hept-6-ene through the (E,Z)-1,3-Cycloheptadiene Intermediate C Qin, SR Davis The Journal of Organic Chemistry 68 (23), 9081-9087, 2003 | 13 | 2003 |
Ab initio study of the thermal isomerization of quadricyclane to norbornadiene C Qin, Z Zhao, SR Davis Journal of Molecular Structure: THEOCHEM 728 (1-3), 67-70, 2005 | 12 | 2005 |
Enhanced interfacial proton migration on BaZr (Y) O3 by molten carbonate: a first principles study X Lei, K Huang, C Qin Solid State Ionics 289, 48-54, 2016 | 10 | 2016 |
Energetics of proton transfer in alkali carbonates: a first principles calculation X Lei, C Qin, K Huang RSC advances 5 (69), 56205-56209, 2015 | 10 | 2015 |