Baofu Qiao

As Baofu Qiao is not a member of our working group anymore, the information on this page might be outdated.

Dr. Baofu Qiao
Postdoc

Office:	209
Phone:	+49 711 685-63607
Fax:	+49 711 685-63658
Email:	qiaobf _at_ icp.uni-stuttgart.de
Address:	Dr. Baofu Qiao Institute for Computational Physics Universität Stuttgart Allmandring 3 70569 Stuttgart Germany

Dr. Qiao got his PhD degree in 2006 at Institute of Chemistry, Chinese Academy of Sciences, where he majored in Polymer Physics and learned Statistical Thermodynamics and Monte Carlo simulation method. His PhD Dissertation was "Statistical Thermodynamics of Polymer Fluid Systems". Since as early as 2005, he stated to investigate charged systems, e.g., ionic liquid, Polyelectrolyte Multilayers and surfactant via various simulation apporaches.

Selected Publications:

Please see here for a complete list.

Polyelectrolyte Multilayer

• Baofu Qiao, Marcello Sega, Christian Holm.
  An atomistic study of a poly(styrene sulfonate)/poly(diallyldimethylammonium) bilayer: the role of surface properties and charge reversal.
  Physical Chemistry Chemical Physics 13(36):16336–16342, 2011.
  [PDF] (4.6 MB) [DOI]
• Baofu Qiao, Juan J. Cerdà, Christian Holm.
  Atomistic Study of Surface Effects on Polyelectrolyte Adsorption: Case Study of a Poly(styrenesulfonate) Monolayer.
  Macromolecules 44(6):1707–1718, 2011.
  [PDF] (3.6 MB) [DOI]
• Baofu Qiao, Juan J. Cerdà, Christian Holm.
  Poly(styrenesulfonate)-Poly(diallyldimethylammonium) Mixtures: Toward the Understanding of Polyelectrolyte Complexes and Multilayers via Atomistic Simulations.
  Macromolecules 43(18):7828–7838, 2010.
  [PDF] (2.3 MB) [DOI]
• Juan J. Cerdà, Baofu Qiao, Christian Holm.
  Understanding polyelectrolyte multilayers: an open challenge for simulations.
  Soft Matter 5:4412–4425, 2009.
  [PDF] (1.7 MB) [DOI]

Ionic Liquid

• Hui Sun, Baofu Qiao, Dongju Zhang, Chengbu Liu.
  Structure of 1-Butylpyridinium Tetrafluoroborate Ionic Liquid: Quantum Chemistry and Molecular Dynamic Simulation Studies.
  Journal of Physical Chemistry A 114:3990–3996, 2010.
  [PDF] (3.3 MB) [DOI]
• Baofu Qiao, Christian Krekeler, Robert Berger, Luigi Delle Site, Christian Holm.
  Effect of Anions on Static Orientational Correlations, Hydrogen Bonds, and Dynamics in Ionic Liquids: A Simulational Study.
  The Journal of Physical Chemistry B 112(6):1743–1751, 2008.
  [PDF] (361 KB) [DOI]

Surfactant

• Baogen Duan, Xiongfei Zhang, Baofu Qiao, Bin Kong, Xiaozhen Yang.
  Description of Ionic Surfactant/Water System by Adjusting Mesoscopic Parameters.
  Journal of Physical Chemistry B 113(26):8854–8859, 2009.
  [DOI]

Statistical Thermodynamics

• Baofu Qiao, Delu Zhao.
  A theory of polymer solutions without the mean-field approximation in Flory-Huggins theory.
  The Journal of Chemical Physics 121(10):4968–4973, 2004.