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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
2017 Dispersion-Corrected Spin-Component-Scaled Double-Hybrid Density Functional Theory: Implementation and Performance for Non-covalent Interactions Roch, Loic M.; Baldridge, Kim K. Journal of Chemical Theory and Computation 13
2017 Evidence of enhanced photocurrent response in corannulene films Pastukhova, N.; Samos, L. Martin; Zoppi, L.; et al. Rsc Advances 7
2017 General optimization procedure towards the design of a new family of minimal parameter spin-component-scaled double-hybrid density functional theory Roch, Loic M.; Baldridge, Kim K. Physical Chemistry Chemical Physics 19
2017 Indenocorannulene-Based Materials: Effect of Solid-State Packing and Intermolecular Interactions on Optoelectronic Properties Roch, Loic M.; Zoppi, Laura; Siegel, Jay S.; et al. Journal of Physical Chemistry C 121
2017 Photoactivated Transition-Metal Triggers for Ambient Temperature Enediyne and Dienyne Cyclization: Ruthenium-eta(6)-Naphthalene Complexes Qin, Pengjin; Cope, Stephen K.; Steger, Han; et al. Organometallics 36
2017 Stereoselective Formation of eta(6)-Arene Ruthenium(II) Complexes via Metal-Triggered Bergman and Hopf Cycloaromatizations Hitt, David M.; Holland, Ryan L.; Baldridge, Kim K.; et al. Organometallics 36
2017 Synthesis and full characterization of an iridium B-H activation intermediate of the monocarba-closo-dodecaborate anion Shen, Yunjun; Pan, Yani; Liu, Jiyong; et al. Chemical Communications 53
2017 Transition Metal Complexes of a Monocarba-closo-dodecaborate Ligand via B-H Activation Shen, Yunjun; Liu, Jiyong; Sattasatchuchana, Tosaporn; et al. European Journal of Inorganic Chemistry
2017 Trifluoromethyl/Perfluoroalkyl Corannulenes: Directed Synthesis and Photophysical Characterization Xia, Yeqing; Guo, TianJian; Baldridge, Kim K.; et al. European Journal of Organic Chemistry
2017 [3 3] Cyclocondensation of Disubstituted Biphenyl Dialdehydes: Access to Inherently Luminescent and Optically Active Hexa-substituted C-3-Symmetric and Asymmetric Trianglimine Macrocycles Wang, Zhenzhen; Nour, Hany F.; Roch, Loic M.; et al. Journal of Organic Chemistry 82