| Density functional theory study of the structure and energetics of negatively charged oligopyrroles Y Dai, S Chowdhury, E Blaisten‐Barojas International Journal of Quantum Chemistry 111 (10), 2295-2305, 2011 | 57 | 2011 |
| Diffusion and desorption of oxygen atoms on graphene Y Dai, S Ni, Z Li, J Yang Journal of Physics: Condensed Matter 25 (40), 405301, 2013 | 43 | 2013 |
| Energetics, structure, and charge distribution of reduced and oxidized n-pyrrole oligomers: A density functional approach Y Dai, E Blaisten-Barojas Journal of Chemical Physics 129 (16), 164903, 2008 | 32 | 2008 |
| Energetics and vibrational analysis of methyl salicylate isomers RD Massaro, Y Dai, E Blaisten-Barojas The Journal of Physical Chemistry A 113 (38), 10385-10390, 2009 | 31 | 2009 |
| Density Functional Study of Nonlinear Optical Properties of Grossly Warped Nanographene C80H30 Y Dai, Z Li, J Yang The Journal of Physical Chemistry C 118 (6), 3313-3318, 2014 | 27 | 2014 |
| Monte Carlo study of oligopyrroles in condensed phases Y Dai, E Blaisten-Barojas The Journal of chemical physics 133 (3), 034905, 2010 | 21 | 2010 |
| Pressure and disorder effects on the half-metallic character and magnetic properties of the full-Heusler alloy Co< sub> 2</sub> FeSi X Zhu, Y Wang, L Wang, Y Dai, C Luo Journal of Physics and Chemistry of Solids 75 (3), 391-396, 2014 | 19 | 2014 |
| Pressure distribution based optimization of phase-coded acoustical vortices H Zheng, L Gao, Q Ma, Y Dai, D Zhang Journal of Applied Physics 115 (8), 084909, 2014 | 17 | 2014 |
| Energetics, Structure, and Electron Detachment Spectra of Calcium and Zinc Neutral and Anion Clusters: A Density Functional Theory Study Y Dai, E Blaisten-Barojas The Journal of Physical Chemistry A 112 (44), 11052-11060, 2008 | 10 | 2008 |
| Density functional theory study of neutral and oxidized thiophene oligomers Y Dai, C Wei, E Blaisten-Barojas The Journal of chemical physics 139 (18), 184905, 2013 | 9 | 2013 |
| Bipolarons and polaron pairs in oligopyrrole dications Y Dai, C Wei, E Blaisten-Barojas Computational and Theoretical Chemistry 993, 7-12, 2012 | 8 | 2012 |
| Comment on “Electrical-Driven Transport of Endohedral Fullerene Encapsulating a Single Water Molecule” Z Chi, C Luo, Y Dai Physical Review Letters 113 (11), 119601, 2014 | 6 | 2014 |
| Dynamical Monte Carlo studies of the three-dimensional bimodal random-field Ising model W Xiong, Y Dai Journal of Statistical Mechanics: Theory and Experiment 2012 (05), P05018, 2012 | 6 | 2012 |
Jinlong YangProfessor of Physical Chemistry, University of Science & Technology of ChinaVerified email at ustc.edu.cn
