Analytical Light Bullet Solutions to the Generalized -Dimensional Nonlinear Schrödinger Equation M Belić, N Petrović, WP Zhong, RH Xie, G Chen Physical Review Letters 101 (12), 123904, 2008 | 183 | 2008 |

Exact spatial soliton solutions of the two-dimensional generalized nonlinear Schrödinger equation with distributed coefficients WP Zhong, RH Xie, M Belić, N Petrović, G Chen, L Yi Physical Review A 78 (2), 023821, 2008 | 139 | 2008 |

The excitation of extended red emission: New constraints on its carrier from hubble space telescope observations of NGC 7023 AN Witt, KD Gordon, UP Vijh, PH Sell, TL Smith, RH Xie The Astrophysical Journal 636 (1), 303, 2006 | 116 | 2006 |

Theoretical analysis of dynamic chemical imaging with lasers using high-order harmonic generation VH Le, AT Le, RH Xie, CD Lin Physical Review A 76 (1), 013414, 2007 | 111 | 2007 |

Genetic algorithms for the geometry optimization of atomic and molecular clusters J Zhao, RH Xie Journal of Computational and Theoretical Nanoscience 1 (2), 117-131, 2004 | 111 | 2004 |

Tailorable Acceptor C 60− n B n and Donor C 60− m N m Pairs for Molecular Electronics RH Xie, GW Bryant, J Zhao, VH Smith Jr, A Di Carlo, A Pecchia Physical review letters 90 (20), 206602, 2003 | 101 | 2003 |

First-principles calculations of structural, electronic, vibrational, and magnetic properties of and A comparative study RH Xie, GW Bryant, L Jensen, J Zhao, VH Smith Jr The Journal of chemical physics 118 (19), 8621-8635, 2003 | 95 | 2003 |

Nonlinear optical properties of armchair nanotube RH Xie, J Jiang Applied physics letters 71 (8), 1029-1031, 1997 | 87 | 1997 |

Structure, Stability, and NMR Properties of Lower Fullerenes C_{38}−C_{50} and Azafullerene C_{44}N_{6}G Sun, MC Nicklaus, R Xie The Journal of Physical Chemistry A 109 (20), 4617-4622, 2005 | 65 | 2005 |

Comparative Studies of the *trans*−*cis* Photoisomerizations of Azobenzene and a Bridged AzobenzeneCW Jiang, RH Xie, FL Li, RE Allen The Journal of Physical Chemistry A 115 (3), 244-249, 2011 | 64 | 2011 |

Excitations, optical absorption spectra, and optical excitonic gaps of heterofullerenes. I. and Theory and experiment RH Xie, GW Bryant, G Sun, MC Nicklaus, D Heringer, T Frauenheim, ... The Journal of chemical physics 120 (11), 5133-5147, 2004 | 62 | 2004 |

Simple three-parameter model potential for diatomic systems: From weakly and strongly bound molecules to metastable molecular ions RH Xie, J Gong Physical review letters 95 (26), 263202, 2005 | 60 | 2005 |

Robust three-dimensional spatial soliton clusters in strongly nonlocal media WP Zhong, L Yi, RH Xie, M Belić, G Chen Journal of Physics B: Atomic, Molecular and Optical Physics 41 (2), 025402, 2008 | 58 | 2008 |

Tuning spectral properties of fullerenes by substitutional doping RH Xie, GW Bryant, G Sun, T Kar, Z Chen, VH Smith Jr, Y Araki, ... Physical Review B 69 (20), 201403, 2004 | 58 | 2004 |

Structural, electronic, and magnetic properties of heterofullerene C48B12 RH Xie, L Jensen, GW Bryant, J Zhao, VH Smith Jr Chemical physics letters 375 (5-6), 445-451, 2003 | 56 | 2003 |

Tunable optical properties of icosahedral, dodecahedral, and tetrahedral clusters RH Xie, GW Bryant, J Zhao, T Kar, VH Smith Jr Physical Review B 71 (12), 125422, 2005 | 55 | 2005 |

Optical properties and photonic devices of doped carbin nanotubes J Zhao, X Chen, RH Xie, John Analytical Chimica Acta 568 (1-2), 161-170, 2006 | 53 | 2006 |

Electronic, vibrational and magnetic properties of a novel C48N12 aza-fullerene RH Xie, GW Bryant, VH Smith Jr Chemical physics letters 368 (3-4), 486-494, 2003 | 51 | 2003 |

What is the best density functional to describe water clusters: evaluation of widely used density functionals with various basis sets for (H2O)N (N=1-10) F Li, L Wang, J Zhao, RH Xie, John, E Riley, Kevin, Z Chen Theor. Chem. Acc. 130 (2/3), 341-352, 2011 | 50 | 2011 |

Formation of stable fullerenelike Ga n As n clusters (6≤ n≤ 9): Gradient-corrected density-functional theory and a genetic global optimization approach J Zhao, RH Xie, X Zhou, X Chen, W Lu Physical Review B 74 (3), 035319, 2006 | 48 | 2006 |