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
1999 Controlling the shape and dynamics of the corannulene nucleus Seiders, T. J.; Elliot, E.; Baldridge, K. K.; et al. Abstracts of Papers of the American Chemical Society 217
1999 Correlation of empirical delta(TMS) and absolute NMR chemical shifts predicted by ab initio computations Baldridge, K. K.; Siegel, J. S. Journal of Physical Chemistry A 103
1999 Envelope-flip dynamics in CpCo(diene) complexes: an ab initio quantum mechanical study Baldridge, K. K.; O’Connor, J. M.; Chen, M. C.; et al. Journal of Physical Chemistry A 103
1999 Interconversion and reactions of in- and out-isomers of a triarylphosphine-containing cyclophane Chen, Y. T.; Baldridge, K. K.; Ho, D. M.; et al. Journal of the American Chemical Society 121
1999 Reinvestigation of sigma-allyl cations: High level ab initio quantum mechanical predictions Baldridge, K. K.; Leahy, J.; Siegel, J. S. Tetrahedron Letters 40
1999 Synthesis and quantum mechanical structure of sym-pentamethylcorannulene and decamethylcorannulene Seiders, T. J.; Baldridge, K. K.; Elliott, E. L.; et al. Journal of the American Chemical Society 121
1999 The structure of hexabenzotriphenylene and the problem of overcrowded "D-3h" polycyclic aromatic compounds Barnett, L.; Ho, D. M.; Baldridge, K. K.; et al. Journal of the American Chemical Society 121
1998 The nature of the long bond in 3,8-dichloro-1,1,2,2-tetraphenylcyclobuta b naphthene Baldridge, K. K.; Kasahara, Y.; Ogawa, K.; et al. Journal of the American Chemical Society 120
1998 X-ray crystal and ab initio structure of 3-ethynylcyclopropene: a curiously short carbon-carbon double bond Baldridge, K. K.; Biggs, B.; Blaser, D.; et al. Chemical Communications
1997 Ab initio density functional vs Hartree Fock predictions for the structure of 18 annulene: Evidence for bond localization and diminished ring currents in bicycloannelated 18 annulenes Baldridge, K. K.; Siegel, J. S. Angewandte Chemie-International Edition in English 36