Institute of High Performance Computing

• Directors
• Computing Science (CS)
• Electronics & Photonics (EP)
• Engineering Mechanics (EM)
• Fluid Dynamics (FD)
• Material Science & Engineering (MSE)
• IHPC Independent Investigatorship (I³)

Material Science & Engineering (MSE)

Dr. CHWEE Tsz Sian Jeremy

• Title: Scientist
• Tel: 64191319
• Email: chweetsj@ihpc.a-star.edu.sg

Research Interests:

• Reduced Scaling Electron Correlation Methods
• Intermolecular Forces
• Electronic Excited States

Qualifications:

• B.Sc.(Chemistry), NUS (2004)
• M.Sc.(Chemistry), NUS (2005)
• Ph.D. (Chemistry), Princeton University (2010)

Published Journals/ Articles:

Journals

1. T. S. Chwee and M. B. Sullivan, “Adsorption studies of C6H6 on Cu (111), Ag (111), and Au (111) within dispersion corrected density functional theory”, J. Chem. Phys., 137, 134703, (2012).
2. T. S. Chwee and E. A. Carter, “Valence Excited States in Large Molecules via Local Multireference Singles and Doubles Configuration Interaction”, J. Chem. Theory Comput., 7, 103 (2011).
3. T. S. Chwee and E. A. Carter, “Cholesky Decomposition within Local Multireference Singles and Doubles Configuration Interaction”, J. Chem. Phys., 132, 074104 (2010).
4. T. S. Chwee and E. A. Carter, “Density Fitting of Two-Electron Integrals in Local Multireference Single and Double Excitation Configuration Interaction Calculations”, Mol. Phys., 108, 2519 (2010).
5. T. S. Chwee, A. B. Szilva, R. Lindh, and E. A. Carter, “Linear Scaling Multireference Singles and Doubles Configuration Interaction”, J. Chem. Phys., 128, 224106 (2008).
6. S. Li, T. S. Chwee, and W. Y. Fan, “FTIR studies on the gas phase laser-induced decomposition of CF3CH2ONO”, Chem. Phys., 320, 259 (2006).
7. T. S. Chong, T. S. Chwee, W. K. Leong, W. Y. Fan, “Methyl abstraction kinetics of CpFe (CO) 2Me using the benzyl radical clock”, J. Organo. Metal. Chem., 691, 687 (2006).
8. S. Li, T. S. Chwee, and W. Y. Fan, “FTIR Studies of O(3P) Atom Reactions with CSe2, SCSe, and OCSe”, J. Phys. Chem. A, 109, 11815 (2005)
9. M. W. Wong, T. S. Chwee, and R. Steudel, “Electrophilic Attack on Sulfur−Sulfur Bonds. 1. Protonation of Various Isomers of the Homoatomic Sulfur Molecules Sn (n = 2−8)”, J. Phys. Chem. A, 108, 7091 (2004).

Conferences

• 07/08 ACTC 2008 Evanston, Illinois (Poster)
• 03/09 ACS Meeting 2009 Salt Lake City, Utah (Talk)