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Article

He, M. X. and Zhang, R. Q. and Niehaus, Thomas A. and Frauenheim, Th. and Lee, S. T. (2009) Sensitivity of hydrogenated silicon nanodot on small polar molecules. J. Theo. & Comp. Chem. 8, pp. 299-316.

Li, Q. S. and Zhang, R. Q. and Lee, S. T. and Niehaus, Thomas A. and Frauenheim, Th. (2008) Amine-capped silicon quantum dots. Appl. Phys. Lett. 92, 053107.

Wang, X. and Zhang, R. Q. and Lee, S. T. and Frauenheim, Th. and Niehaus, Thomas A. (2008) Anomalous Size Dependence of the Photoluminescence in reconstructed Silicon Nanoparticles. Appl. Phys. Lett. 93, p. 243120.

Li, Q. S. and Zhang, R. Q. and Lee, S. T. and Niehaus, Thomas A. and Frauenheim, Th. (2008) Optimal Surface Functionalization of Silicon Quantum Dots. J. Chem. Phys. 128, p. 244714.

Wang, X. and Zhang, R. Q. and Niehaus, Thomas A. and Frauenheim, Th. and Lee, S. T. (2007) Hydrogenated silicon nanoparticles relaxed in excited states. J. Phys. Chem. C 111, p. 12588.

Li, Q.S. and Zhang, R. Q. and Niehaus, Thomas A. and Frauenheim, Th. and Lee, S. T. (2007) Stabilizing excited-state silicon nanoparticles by surface oxidation. Appl. Phys. Lett. 91, 043106.

Li, Q. S and Zhang, R. Q. and Niehaus, Thomas A. and Frauenheim, Th. and Lee, S. T. (2007) Theoretical studies on optical and electronic properties of propionic-acid-terminated silicon quantum dots. J. Chem. Theo. Comput. 3, p. 1518.

Wang, X. and Zhang, R. Q. and Lee, S. T. and Niehaus, Thomas A. and Frauenheim, Th. (2007) Unusual size dependence of the optical emission gap in small hydrogenated silicon nanoparticles. Appl. Phys. Lett. 90, p. 123116.

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