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
1995 LONE C-C SINGLE BONDS IN ANTHRACENE DIMERS - THE STRUCTURE OF BI(ANTHRACENE-9,10-DIMETHYLENE) PHOTODIMER IS REDETERMINED Battersby, T. R.; Gantzel, P.; Baldridge, K. K.; et al. Tetrahedron Letters 36
1995 PARTIAL BOND LOCALIZATION IN THE CRYSTAL-STRUCTURE OF TRISBICYCLO 2.2.1 HEPTABENZENE AND ITS EFFECT ON CR-ARENE DYNAMICS Frank, N. L.; Baldridge, K. K.; Gantzel, P.; et al. Tetrahedron Letters 36
1995 PROMISES AND PERILS OF PARALLEL SEMIEMPIRICAL QUANTUM METHODS Baldridge, K. K. Parallel Computing in Computational Chemistry 592
1995 QMVIEW - A COMPUTATIONAL CHEMISTRY 3-DIMENSIONAL VISUALIZATION TOOL AT THE INTERFACE BETWEEN MOLECULES AND MANKIND Baldridge, K. K.; Greenberg, J. P. Journal of Molecular Graphics 13
1995 QMView: a computational chemistry three-dimensional visualization tool at the interface between molecules and mankind. Baldridge, K K; Greenberg, J P Journal of molecular graphics 13
1995 QMVIEW: As a supramolecular visualization tool Baldridge, K. K.; Greenberg, J. P. Supramolecular Stereochemistry 473
1995 SOLVENT, ISOTOPE, AND SUBSTITUENT EFFECTS ON THE BIMOLECULAR ELECTRON-TRANSFER REACTION BETWEEN CHLORINE OXIDE AND BENZENES Doolen, R.; Simon, J. D.; Baldridge, K. K. Journal of Physical Chemistry 99
1995 SYNTHESIS AND CHARACTERIZATION OF TRISBICYCLO 2.1.1 HEXABENZENE, A HIGHLY STRAINED BICYCLOANNELATED BENZENE Frank, N. L.; Baldridge, K. K.; Siegel, J. S. Journal of the American Chemical Society 117
1995 Synthesis and structure of the nanodimensional multicyclophane ’’Kuratowski cyclophane’’, an achiral molecule with nonplanar K-3,K-3 topology Chen, C. T.; Gantzel, P.; Siegel, J. S.; et al. Angewandte Chemie-International Edition 34
1995 THE CENTRAL BOND-LENGTH IN 1,2-DIARYLETHANES Kahr, B.; Mitchell, C. A.; Chance, J. M.; et al. Journal of the American Chemical Society 117