Home / People / / Kim Baldridge

Kim Baldridge——

Nationality:
USA
Phone:
022-87402055
Email:
kimb@tju.edu.cn
Office:
Room A204, Building 24, Tianjin University
School:
School of Pharmaceutical Science and Technology
ResearcherID:
Group weblink
Education Experience
1988 Ph. D. North Dakota State University, USA
1994 Postdoctoral Wesleyan University, Connecticut, USA
Professional Experience
Research Area

The Baldridge group research involves development of theoretical methods for treatment of molecules in complex environments, with focus on the development of quantum mechanical-based methods, dispersion enabled density functional theory, and plane-wave GW based methodologies. Particular emphasis is on development of QM-solvation methods, QM-hybrid methods, and cost-effective single reference dynamic correlation methods. Applications span systems in gas-phase, supramolecular complexes, monolayer-surface interfaces, bulk condensed media, and structured crystalline environments.Through experimental collaborations, these tools enable better understanding of technologically and biologically important chemical structures and reaction processes. The group is part of the international team of developers of the electronic structure theory software, GAMESS.

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Honors and Awards
Tianjin Haihe Award, 2015
Minot State University Hall of Fame Induction, 2013
Fellow of the American Association of the Advancement of Science, 2001
Fellow of the American Physical Society, 2000
Agnes Fay Morgan Research Award, March, 2000
Fulbright Award, 1997
NSF Visiting Professorship for Women Award, 1995
NSF Research Opportunities for Women Award, 1993
NIH Postdoctoral Fellow Award, 1989.
Patents
Highlighted Publications
Sattasathuchana, T.; Baldridge, K. K. Multidimensional Franck-Condon Factor Determination for Accurate Prediction of Photoelectron Spectra, J. Chem. Theor. Comput., 2017, 13, 2147.
Roch, L. M.; Baldridge, K. K. Dispersion-corrected spin-component-scaled double-hybrid density functional theory: implementation and performance on weakly interacting systems, J. Chem. Theor. Comput., 2017, 13, 2650.
Zoppi, L.; Baldridge, K.K. From Charge-Transfer Excitations to Charge Transport mediated by Super Atomic Molecular Orbitals, Int. J. Quant. Chem. (Special Edition, Invited), 2017, DOI: 10.1002/qua.25413.
Deng, Y.; Xu, B.; Baldridge, K. K.; Siegel, J.S. Decakis(arylthio)corannulenes: Transferable Photochemical & Redox Parameters and Photovoltaic Device Performance, Eur. J. Org. Chem., 2017, DOI: 10.1002/ejoc.201700861
Roch, L. M.; Baldridge, K. K. General Optimization Procedure Towards the Design of a New Family of Minimal Parameter Spin-Component-Scaled Double-Hybrid Density Functional Theory, Phys. Chem. Chem. Phys., 2017, 19, 26191 - 26200.
ResearcherID Publications
Year Title Author(s) Source Volume
2009 Implementation and Optimization of DFT-D/COSab with Respect to Basis Set and Functional: Application to Polar Processes of Furfural Derivatives in Solution Peverati, R.; Baldridge, K. K. Journal of Chemical Theory and Computation 5
2009 Photophysics of manisyl-substituted 2-pyridin-2-yl-1,10-phenanthrolines. Dual emission dependent on structure and solvent Klosterman, J. K.; Baldridge, K. K.; Siegel, J. S. Physical Chemistry Chemical Physics 11
2009 Reversible Phase Transitions in a Buckybowl Monolayer Merz, L.; Parschau, M.; Zoppi, L.; et al. Angewandte Chemie-International Edition 48
2009 Synthesis and Crystal Structure of a Silyl-Stabilized Allyl Cation Formed by Disruption of an Arene by a Protonation-Hydrosilylation Sequence Duttwyler, S.; Zhang, Y.; Linden, A.; et al. Angewandte Chemie-International Edition 48
2009 Synthesis, X-ray crystal structures, and computational studies of 1,1 ’-bridged 4,4 ’-diaryl-2,2 ’-bibenzimidazoles: building blocks for supramolecular structures Frantz, D. K.; Sullivan, A. A.; Yasui, Y.; et al. Organic & Biomolecular Chemistry 7
2009 Thermodynamic and Computational Studies on the Binding of p53-Derived Peptides and Peptidomimetic Inhibitors to HDM2 Grasslin, A.; Amoreira, C.; Baldridge, K. K.; et al. Chembiochem 10
2008 Chemomentum - UNICORE 6 based infrastructure for complex applications in science and technology Schuller, B.; Demuth, B.; Mix, H.; et al. Euro-Par 2007 Workshops: Parallel Processing 4854
2008 Implementation and Performance of DFT-D with Respect to Basis Set and Functional for Study of Dispersion Interactions in Nanoscale Aromatic Hydrocarbons Peverati, R.; Baldridge, K. K. Journal of Chemical Theory and Computation 4
2008 Mark S. Gordon - Introduction Baldridge, K. K.; Schmidt, M. W. Theoretical Chemistry Accounts 120
2008 Modulating the Lewis acidity of boron using a photoswitch Lemieux, V.; Spantulescu, M. D.; Baldridge, K. K.; et al. Angewandte Chemie-International Edition 47