Lista de obras - Rebecca L. Gieseking - Dominio Público Uruguay

25th anniversary article: Design of polymethine dyes for all-optical switching applications: guidance from theoretical and computational studies

artículo científico

A new release of MOPAC incorporating the INDO/S semiempirical model with CI excited states

scientific article published on 23 November 2020

Benchmarking Density Functional Theory Approaches for the Description of Symmetry Breaking in Long Polymethine Dyes

Benchmarking Post-Hartree-Fock Methods To Describe the Nonlinear Optical Properties of Polymethines: An Investigation of the Accuracy of Algebraic Diagrammatic Construction (ADC) Approaches

artículo científico publicado en 2016

Benchmarking Semiempirical Methods To Compute Electrochemical Formal Potentials

artículo científico publicado en 2018

Bias-Dependent Chemical Enhancement and Nonclassical Stark Effect in Tip-Enhanced Raman Spectromicroscopy of CO-Terminated Ag Tips

artículo científico publicado en 2018

Complementary halogen and hydrogen bonding: sulfur...iodine interactions and thioamide ribbons

artículo científico publicado en 2010

Distinguishing the Effects of Bond-Length Alternation versus Bond-Order Alternation on the Nonlinear Optical Properties of π-Conjugated Chromophores

artículo científico publicado en 2015

Effect of Bulky Substituents on Thiopyrylium Polymethine Aggregation in the Solid State: A Theoretical Evaluation of the Implications for All-Optical Switching Applications

Impact of Bulk Aggregation on the Electronic Structure of Streptocyanines: Implications for the Solid-State Nonlinear Optical Properties and All-Optical Switching Applications

Impact of the Nature of the Excited-State Transition Dipole Moments on the Third-Order Nonlinear Optical Response of Polymethine Dyes for All-Optical Switching Applications

Implementation of INDO/SCI with COSMO Implicit Solvation and Benchmarking for Solvatochromic Shifts

artículo científico publicado en 2016

Molecular engineering of organic semiconductors enables noble metal-comparable SERS enhancement and sensitivity

artículo científico publicado en 2019

Nonlinear Optical Properties of X(C6H5)4 (X = B–, C, N+, P+): A New Class of Molecules with a Negative Third-Order Polarizability

scientific article published on 23 July 2015

Parametrization of the PM7 Semiempirical Quantum Mechanical Method for Silver Nanoclusters

artículo científico publicado en 2022

Polymethine materials with solid-state third-order optical susceptibilities suitable for all-optical signal-processing applications

Quantum Mechanical Identification of Quadrupolar Plasmonic Excited States in Silver Nanorods

artículo científico publicado en 2016

Semiempirical Modeling of Ag Nanoclusters: New Parameters for Optical Property Studies Enable Determination of Double Excitation Contributions to Plasmonic Excitation

artículo científico publicado en 2016

Lista de obras de Rebecca L. Gieseking

25th anniversary article: Design of polymethine dyes for all-optical switching applications: guidance from theoretical and computational studies

A new release of MOPAC incorporating the INDO/S semiempirical model with CI excited states

Benchmarking Density Functional Theory Approaches for the Description of Symmetry Breaking in Long Polymethine Dyes

Benchmarking Post-Hartree-Fock Methods To Describe the Nonlinear Optical Properties of Polymethines: An Investigation of the Accuracy of Algebraic Diagrammatic Construction (ADC) Approaches

Benchmarking Semiempirical Methods To Compute Electrochemical Formal Potentials

Bias-Dependent Chemical Enhancement and Nonclassical Stark Effect in Tip-Enhanced Raman Spectromicroscopy of CO-Terminated Ag Tips

Complementary halogen and hydrogen bonding: sulfur...iodine interactions and thioamide ribbons

Distinguishing the Effects of Bond-Length Alternation versus Bond-Order Alternation on the Nonlinear Optical Properties of π-Conjugated Chromophores

Effect of Bulky Substituents on Thiopyrylium Polymethine Aggregation in the Solid State: A Theoretical Evaluation of the Implications for All-Optical Switching Applications

Impact of Bulk Aggregation on the Electronic Structure of Streptocyanines: Implications for the Solid-State Nonlinear Optical Properties and All-Optical Switching Applications

Impact of the Nature of the Excited-State Transition Dipole Moments on the Third-Order Nonlinear Optical Response of Polymethine Dyes for All-Optical Switching Applications

Implementation of INDO/SCI with COSMO Implicit Solvation and Benchmarking for Solvatochromic Shifts

Molecular engineering of organic semiconductors enables noble metal-comparable SERS enhancement and sensitivity

Nonlinear Optical Properties of X(C6H5)4 (X = B–, C, N+, P+): A New Class of Molecules with a Negative Third-Order Polarizability

Parametrization of the PM7 Semiempirical Quantum Mechanical Method for Silver Nanoclusters

Polymethine materials with solid-state third-order optical susceptibilities suitable for all-optical signal-processing applications

Quantum Mechanical Identification of Quadrupolar Plasmonic Excited States in Silver Nanorods

Semiempirical Modeling of Ag Nanoclusters: New Parameters for Optical Property Studies Enable Determination of Double Excitation Contributions to Plasmonic Excitation

Understanding the Relationships Among Molecular Structure, Excited-State Properties, and Polarizabilities of π-Conjugated Chromophores