近期论文

N. N. Ma, S. L. Sun, C. G. Liu, X. X. Sun, Y. Q. Qiu*, Quantum Chemical Study of Redox-Switchable Second-Order Nonlinear Optical Responses of D-π-A System BNbpy and Metal Pt(II) Chelate Complex, J. Phys. Chem. A, 2011, 115, 13564.(SCI)
X. X. Sun, G. C. Yang, S. L. Sun, N. N. Ma, Y. Q. Qiu*, Effects of the substituting groups and proton abstraction on the nonlinear optical properties of heteroleptic bis-tridentate Ru(II) complexes, J. Organomet. Chem., 2011, 696, 3384.(SCI)
X. N. Sun, Y. Q. Qiu*, S. L. Sun, C. G. Liu, Y. Q. Du, Z. M. Su**, Theoretical study on stability and nonlinear optical properties of tetrahydropyrrole diradical and its isoelectronic systems in different electronic states, Science China Chemistry, 2011, 54(7), 1086.(SCI)
N. N. Ma, G. C. Yang, S. L. Sun, C. G. Liu, Y. Q. Qiu*, Computational study on second-order nonlinear optical (NLO) properties of a novel class of two-dimensional Λ- and W-shaped sandwich metallocarborane-containing chromophores, J. Organomet. Chem., 2011, 696, 2380.(SCI)
M. Fan, S. L. Sun, Y. Q. Qiu*, X. D. Liu, Z. M. Su, DFT Study on the Second-Order Nonlinear Optical Property of 12-Vertex Close-Carborane Derivatives, Int. J. Quantum Chem., 2011,111(5),1039.(SCI)
H. B. Zhao, Y. Q. Qiu*, C. G. Liu, S. L. Sun, R. S. Wang, Redox-switchable second-order nonlinear optical responses of TEMPO-dithiolate ligand and (tempodt)M complexes (M= Pt, Pd), J. Organomet. Chem., 2010, 695, 2251.(SCI)
H. B. Zhao, S. L. Sun, Y. Q. Qiu*, C. G. Liu, Z. M. Su, Theoretical Study on Second-Order Nonlinear Optical Properties of Spin Crossover Fe(III) Phenolate-Pyridyl Schiff Base Complexes, Int. J. Quantum Chem., 2010, 110(10), 1863.(SCI)
X. D. Liu, Y. Q. Qiu*, H. Chen, N. Li, S. L. Sun, Z. M. Su, DFT study on second-order nonlinear optical properties of Pt(II) complexes with different chromophores, Science in China Series B, 2009, 52(2), 144.(SCI)
C. G. Liu, Y. Q. Qiu*, Z. M. Su, G. C. Yang, S. L. Sun, Computational Study on Second-Order Nonlinear Response of a Series of Two-Dimensional Carbazole-Cored Chromophores, J. Phys. Chem. C, 2008, 112, 7021.(SCI)
Y.Q. Qiu*, H.L. Fan, S.L. Sun, C.G. Liu, Z.M. Su, Theoretical study on the relationship between spin multiplicity effects and nonlinear optical properties of Pyrrole radical (C4H4N•), J. Phys. Chem. A, 2008, 112, 83.(SCI)
Y.Q. Qiu*, X.D. Liu, S.L. Sun, M. Fan, Z.M. Su, R.S. Wang, DFT study on second-order nonlinear optical properties of the derivatives of 7-vertex cobalt–carborane metallocenyl, J. Mol. Structure: THEOCHEM, 2008, 863, 66.(SCI)
Y.M. Fu, Y.H. Zhao, Y.Q. Lan, K.Z. Shao, Y.Q. Qiu* , X.R. Hao, Z.M. Su*, Hydrothermal syntheses, crystal structures and properties of three coordination frameworks based on a new semirigid ligand and benzenedicarboxylate, Journal of Solid State Chemistry, 2008, 181, 2378.(SCI)
Y.Q. Qiu*, H. Chen, S.L. Sun, H.L. Fan, Z.M. Su, Structure and second-order NLO property of the molecules bridged through n-vertex bis-substituted carborane (n=5, 6, 7), Chinese Sci. Bull., 52(17), 2326-2330, 2007.(SCI)
C.G. Liu, Y.Q. Qiu, S.L. Sun, N. Li, G.C. Yang, Z.M. Su, DFT Studies on second- order nonlinear optical properties of mono(salicylaldiminato) Nickel(II) polyenyl Schiff base metal complexes, Chem. Phys. Lett., 443, 183-168, 2007.(SCI)
Y.Q. Qiu, X.H. Wang, Y.C. Liu, G.C. Yang, H. Chen, The investigation on electronic structure and second-order nonlinear optical properties of II-VI semiconductor clusters by time-dependent Density Functional Theory, J. Theor. Comput. Chem., 6(3), 585-594, 2007.(SCI)
Y.M. Fu, Y.H. Zhao, Y.Q. Lan, Y. Wang, Y.Q. Qiu, K.Z. Shao, Z.M. Su, A chiral 3D polymer with right- and left-helices based on 2,2’-biimidazole: Synthesis, crystal structure and fluorescent property, Inorg. Chem. Commun., 10, 270-273, 2007.(SCI)
C.G. Liu, Y.Q. Qiu, S.L. Sun, H. Chen, N. Li, Z.M. Su, DFT study on second-order nonlinear optical properties of a series of mono Schiff-base M(II) (M = Ni, Pd, Pt) complexes, Chem. Phys. Lett., 429, 570-574, 2006.(SCI)

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