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Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions
- Marenich, Aleksandr V.; Cramer, Christopher J.; Truhlar, Donald G.
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The Journal of Physical Chemistry B, Vol. 113, Issue 18, p. 6378-6396
https://doi.org/10.1021/jp810292n
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Alternating Hetero H Aggregation of Different Dyes by Interstrand Stacking from Two DNA-Dye Conjugates
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Energy Transfer Mechanisms and the Molecular Exciton Model for Molecular Aggregates
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Aggregation of Conjugated Polymers in Aromatic Solvent
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Extracting single and two-exciton couplings in photosynthetic complexes by coherent two-dimensional electronic spectra
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Density Functional Theory Investigations of D-A-D' Structural Molecules as Donor Materials in Organic Solar Cell
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July 2016 |
Resonance Energy Transfer in DNA Duplexes Labeled with Localized Dyes
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Cy3 and Cy5 dyes attached to oligonucleotide terminus stabilize DNA duplexes: Predictive thermodynamic model
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November 2011 |
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June 1995 |
Exciton Delocalization in Indolenine Squaraine Aggregates Templated by DNA Holliday Junction Scaffolds
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Substituent Effects on the Assembly of Helical Cyanine Dye Aggregates in the Minor Groove of a DNA Template †
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Covalent Incorporation of Methyl Red Dyes into Double-Stranded DNA for Their Ordered Clustering
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January 2006 |
0–0 Energies Using Hybrid Schemes: Benchmarks of TD-DFT, CIS(D), ADC(2), CC2, and BSE/ GW formalisms for 80 Real-Life Compounds
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October 2015 |
Quantum yield in blue-emitting anthracene derivatives: vibronic coupling density and transition dipole moment density
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The calculations of excited-state properties with Time-Dependent Density Functional Theory
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January 2013 |
TD-DFT Assessment of Functionals for Optical 0–0 Transitions in Solvated Dyes
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January 2018 |
Characterization of azobenzene chromophores for reversible optical data storage: molecular quantum calculations
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π-Extended cis - Configured Unsymmetrical Squaraine Dyes for Dye-Sensitized Solar Cells: Panchromatic Response
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Electrophilic Substituent Constants
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September 1958 |
Optical Properties of Vibronically Coupled Cy3 Dimers on DNA Scaffolds
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April 2018 |
Exciton Delocalization and Transport in Photosystem I of Cyanobacteria Synechococcus elongates : Simulation Study of Coherent Two-Dimensional Optical Signals
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Intermolecular Coulomb Couplings from Ab Initio Electrostatic Potentials: Application to Optical Transitions of Strongly Coupled Pigments in Photosynthetic Antennae and Reaction Centers
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August 2006 |
Analysis of Coherent Heteroclustering of Different Dyes by Use of Threoninol Nucleotides for Comparison with the Molecular Exciton Theory
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October 2009 |
Ultrafast Laser Pulse Control of Exciton Dynamics: A Computational Study on the FMO Complex
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June 2004 |
Fine Structure in Electronic Spectra of Cyanine Dyes: Are Sub-Bands Largely Determined by a Dominant Vibration or a Collection of Singly Excited Vibrations?
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February 2018 |
DNA−Dye Conjugates for Controllable H* Aggregation 1
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A DNA-Based Light-Harvesting Antenna
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Bright Near-Infrared Fluorophores Based on Squaraines by Unexpected Halogen Effects
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November 2011 |
Hybridization-Sensitive On–Off DNA Probe: Application of the Exciton Coupling Effect to Effective Fluorescence Quenching
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June 2008 |
Interaction of YOYO-3 with Different DNA Templates to Form H-Aggregates
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Coherent Exciton Delocalization in a Two-State DNA-Templated Dye Aggregate System
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J-Aggregates: From Serendipitous Discovery to Supramolecular Engineering of Functional Dye Materials
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Design of NIR-Absorbing Simple Asymmetric Squaraine Dyes Carrying Indoline Moieties for Use in Dye-Sensitized Solar Cells with Pt-Free Electrodes
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Davydov Splitting in Squaraine Dimers
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July 2019 |
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Expanded Theory of H- and J-Molecular Aggregates: The Effects of Vibronic Coupling and Intermolecular Charge Transfer
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December 2020 |
Squarylium Dyes: Structural Factors Pertaining to the Negative Third-Order Nonlinear Optical Response
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March 1995 |
Theoretical and experimental determination of the absorption and emission spectra of a prototypical indolenine-based squaraine dye
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Recent developments in reversible photoregulation of oligonucleotide structure and function
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January 2017 |
Engineering couplings for exciton transport using synthetic DNA scaffolds
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March 2021 |
Coherent Quenching of a Fluorophore for the Design of a Highly Sensitive In-Stem Molecular Beacon
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Squaraines as Reporter Units: Insights into their Photophysics, Protonation, and Metal-Ion Coordination Behaviour
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November 2008 |