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.

1.jpg2.png2.png

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
2002 Controlled alcohol-ketone interconversion by dihydrogen transfer: An ab initio study of the methanol-formaldehyde complex Brumer, Y.; Shapiro, M.; Brumer, P.; et al. Journal of Physical Chemistry A 106
2002 Directing power of cyclobutenoid annelations on the double bonds of planar cyclooctatetraenes Baldridge, K. K.; Siegel, J. S. Journal of the American Chemical Society 124
2002 Mutual control of axial and equatorial ligands: Model studies with Ni -bacteriochlorophyll-a Yerushalmi, R.; Noy, D.; Baldridge, K. K.; et al. Journal of the American Chemical Society 124
2001 Baskets, covered baskets, and basket balls: corannulene based cyclophanes as fullerene mimics Seiders, T. J.; Baldridge, K. K.; Siegel, J. S. Tetrahedron 57
2001 Computers expanding impact on chemistry Baldridge, K. K. Chemical & Engineering News 79
2001 National Biomedical Computation Resource Smith, C. M.; Baldridge, K.; Arzberger, P. Faseb Journal 15
2001 Quantum mechanical designs toward planar delocalized cyclooctatetraene: A new target for synthesis Baldridge, K. K.; Siegel, J. S. Journal of the American Chemical Society 123
2001 Structure/energy correlation of bowl depth and inversion barrier in corannulene derivatives: Combined experimental and quantum mechanical analysis Seiders, T. J.; Baldridge, K. K.; Grube, G. H.; et al. Journal of the American Chemical Society 123
2000 Ab initio computational study of environmentally harmful gasoline additives: Methyl tert-butyl ether and analogues Gregerson, L. N.; Siegel, J. S.; Baldridge, K. K. Journal of Physical Chemistry A 104
2000 Ground state gas and solution phase conformational dynamics of polar processes: Furfural systems Baldridge, K. K.; Jonas, V.; Bain, A. D. Journal of Chemical Physics 113