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
1995 THE CRYSTAL-STRUCTURE OF A HEPTIPTYCENE-CHLOROBENZENE CLATHRATE Venugopalan, P.; Burgi, H. B.; Frank, N. L.; et al. Tetrahedron Letters 36
1995 X-RAY-DIFFRACTION EVIDENCE FOR A CYCLOHEXATRIENE MOTIF IN THE MOLECULAR-STRUCTURE OF TRIS(BICYCLO 2.1.1 HEXENO)BENZENE - BOND ALTERNATION AFTER THE REFUTATION OF THE MILLS-NIXON THEORY Burgi, H. B.; Baldridge, K. K.; Hardcastle, K.; et al. Angewandte Chemie-International Edition in English 34
1994 THE EFFECTS OF SOLVENT SCREENING IN QUANTUM-MECHANICAL CALCULATIONS IN PROTEIN SYSTEMS Baldridge, K.; Fine, R.; Hagler, A. Journal of Computational Chemistry 15
1993 BALANCING STERIC AND ELECTRONIC FACTORS IN PUSH-PULL BENZENES - AN AB-INITIO STUDY ON THE MOLECULAR-STRUCTURE OF 1,3,5-TRIAMINO-2,4,6-TRINITROBENZENE AND RELATED-COMPOUNDS Baldridge, K. K.; Siegel, J. S. Journal of the American Chemical Society 115
1993 GENERAL ATOMIC AND MOLECULAR ELECTRONIC-STRUCTURE SYSTEM Schmidt, M. W.; Baldridge, K. K.; Boatz, J. A.; et al. Journal of Computational Chemistry 14
1993 MOLECULAR DESIGN, CHEMICAL SYNTHESIS, KINETIC-STUDIES, CALCULATIONS, AND BIOLOGICAL STUDIES OF NOVEL ENEDIYNES EQUIPPED WITH TRIGGERING, DETECTION, AND DEACTIVATING DEVICES - MODEL DYNEMICIN-A EPOXIDE AND CIS-DIOL SYSTEMS Nicolaou, K. C.; Dai, W. M.; Hong, Y. P.; et al. Journal of the American Chemical Society 115
1993 SYNTHESIS, STRUCTURE, AND DYNAMICS OF ENDO-(STARPHENYLENE)CHROMIUM TRICARBONYL DERIVATIVES - OBSERVATION OF METAL ARENE MIGRATION AND HINDERED METAL-TRIPOD ROTATION Nambu, M.; Mohler, D. L.; Hardcastle, K.; et al. Journal of the American Chemical Society 115
1992 BOND ALTERNATION IN TRIANNELATED BENZENES - DISSECTION OF CYCLIC PI FROM MILLS NIXON EFFECTS Baldridge, K. K.; Siegel, J. S. Journal of the American Chemical Society 114
1992 STRUCTURE OF CENTRALLY BOUND ANGULAR-(TERPHENYLENE)CHROMIUM TRICARBONYL Nambu, M.; Hardcastle, K.; Baldridge, K. K.; et al. Journal of the American Chemical Society 114
1992 SYNTHESIS AND DYNAMICS OF THE CORANNULENE NUCLEUS Borchardt, A.; Fuchicello, A.; Kilway, K. V.; et al. Journal of the American Chemical Society 114