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The Journal of Physical Chemistry Letters|August 13, 2015
Distinguishing the Effects of Bond-Length Alternation versus Bond-Order Alternation on the Nonlinear Optical Properties of π-Conjugated ChromophoresRebecca L Gieseking, Chad Risko, Jean-Luc Brédas
Faraday Discussions|April 27, 2017
Semiempirical modeling of electrochemical charge transferRebecca L Gieseking, Mark A Ratner, George C Schatz
The Journal of Physical Chemistry. A|December 16, 2016
Implementation of INDO/SCI with COSMO Implicit Solvation and Benchmarking for Solvatochromic ShiftsRebecca L Gieseking, Mark A Ratner, George C Schatz
The Journal of Physical Chemistry. A|June 4, 2016
Semiempirical Modeling of Ag Nanoclusters: New Parameters for Optical Property Studies Enable Determination of Double Excitation Contributions to Plasmonic ExcitationRebecca L Gieseking, Mark A Ratner, George C Schatz
The Journal of Physical Chemistry. A|October 28, 2016
Quantum Mechanical Identification of Quadrupolar Plasmonic Excited States in Silver NanorodsRebecca L Gieseking, Mark A Ratner, George C Schatz
Faraday Discussions|September 9, 2017
Theoretical modeling of voltage effects and the chemical mechanism in surface-enhanced Raman scatteringRebecca L Gieseking, Mark A Ratner, George C Schatz
Journal of Molecular Graphics & Modelling|January 12, 2016
Recognition of halides and Y-shaped oxoanions by carbonylchromium-based urea-like molecules: A theoretical analysis of hydrogen bonding modesChao Wang, Yizhong Yuan, Xiaohui Tian, et al.
Chemical Communications (Cambridge, England)|March 4, 2010
Complementary halogen and hydrogen bonding: sulfur...iodine interactions and thioamide ribbonsHadi D Arman, Rebecca L Gieseking, Timothy W Hanks, et al.
Advanced Materials (Deerfield Beach, Fla.)|December 5, 2013
25th anniversary article: Design of polymethine dyes for all-optical switching applications: guidance from theoretical and computational studiesRebecca L Gieseking, Sukrit Mukhopadhyay, Chad Risko, et al.
Journal of Chemical Theory and Computation|October 8, 2016
Benchmarking Post-Hartree-Fock Methods To Describe the Nonlinear Optical Properties of Polymethines: An Investigation of the Accuracy of Algebraic Diagrammatic Construction (ADC) ApproachesStefan Knippenberg, Rebecca L Gieseking, Dirk R Rehn, et al.
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