Curriculumn
Vitae
Department of Chemistry |
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Phone: 713-743-3248(O) |
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University of Houston |
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713-669-8785(H) |
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Houston, TX 77204 |
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Email: shu3@mail.uh.edu |
Research Interest
- Numerical simulations of experimentally realistic systems
- Theoretical analysis of pattern formation in various systems
- Calculations to predict interactions between pairs of molecules
Education
- 8/2001 - present University of Houston, Ph. D candidate in Theoretical Chemical Physics (Expected 2005)
Thesis: Dynamical simulation and characterization of the pattern formation
- 9/1999 - 7/2001 University of New Brunswick, Fredericton, Canada, M.Sc. in Computational and Theoretical Chemistry
Thesis: Hydrogen-bonded clusters of glycolic acid and water: a computational study
- 9/1997 - 7/1999 Wuhan University, Wuhan, China, M.A. in Philosophy of Science
- 9/1987 - 7/1991 Beijing Normal University, Beijing, China, B.Sc. in Chemistry
Thesis: Calculation of the microcanonical rate constants for the fluorine-transfer reaction of fluoro substituted acetylene
Working Experience
1/2002 - present Research assistant, Department of Chemistry, University of Houston
- Programming to simulate the dynamics of self-assembling nanostructures
- Developing various measurements to characterize the patterns formed in systems far from equilibrium
- MPI parallel code development of the numerical solution of Swift-Hohenberg equation
- Numerical calculation of the electronic nonadiabatic coupling terms
9/1999 - 7/2001 Research and Teaching Assistant, Department of Chemistry, University of New Brunswick
- Modeling the hydrogen-bonded clusters of one glycolic acid molecule and several water molecules
- Computational study of the structures and energetics of small hydrogen-bonded clusters
8/1991 - 8/1997 Lecturer and Lab Instructor, Wuhan Chemical Engineering School, Wuhan, China
- Giving lectures of Physical Chemistry, Analytical Chemistry and Instrumental Analytical Chemistry and also working as lab instructor
Computer Skills
- Scientific programming in C, Fortran,
and Matlab
- Unix shell programming and MPI parallel computing
Publications
Stages of relaxation of patterns and the role of stochasticity on the final stage. Shaowen Hu, Daniel I. Goldman, Donald J. Kouri, David K. Hoffman, Harry L. Swinney and Gemunu H. Gunaratne, Nonlinearity 17, 1535 (2004)
Hydrogen-bonded complexes of glycolic acid with one and two water molecules.
A. J. Thakkar, N. E.-B. Kassimi and S. Hu, Chem. Phys. Lett., 387, 142-148 (2004)
Analytic-numerical approach to calculate electronic nonadiabatic coupling terms: study of the C2H molecule and the H2 + H system. Á. Vibók, G. Halász, A. M. Mebel, S. Hu, M. Baer, Int. J. Quantum Chem., 99, 594-604 (2004)
The Curl-Divergence equations for the electronic nonadiabatic coupling terms: study of the C2H molecule and the H2+H system. Shaowen Hu, Gábor Halász, Ágnes Vibók, Alexander M. Mebel and Michael Baer, Chem. Phys. Lett., 367, 177-185 (2003)
Reference
Dr. Donald J. Kouri |
Department of Chemstry, Physics and Mathematics, University of Houston |
Email: kouri@uh.edu |
Phone: 713-743-3245 |
Dr. David K. Hoffman |
Department of Chemistry amd Ames Laboratory, Iowa State University |
Email: hoffman@ameslab.gov |
Phone: 515-294-5515 |
Dr. Gemunu H. Gunaratne |
Department of Physics, University of Houston |
Email: gemunu@uh.edu |
Phone:
713-743-3534 |
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