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Physical Chemistry

Working Paper

Ideal Current-voltage Characteristics and Rectification Performance of Molecular Rectifier under Single Level based Tunneling and Hopping Transport

Xianneng Song, Xi Yu, Wenping Hu

Version 1 posted 01 July 2020

599

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Inorganic Chemistry

Working Paper

Applications of the Marcus cross relation to inner sphere O2 reduction: Implications in Small-Molecule Activation

David Lacy

Version 4 posted 30 July 2019

1,056

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Theoretical and Computational Chemistry

Working Paper

Computation of Oxidation Potentials of Solvated Nucleobases by Static and Dynamic Multilayer Approaches

Jesús Lucia-Tamudo, Gustavo Cárdenas, Nuria Anguita-Ortiz, Sergio Díaz-Tendero, Juan J. Nogueira

Version 1 posted 12 January 2022

309

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Energy

Working Paper

Towards a Mechanistic Model of Solid-Electrolyte Interphase Formation and Evolution in Lithium-ion Batteries

Evan Walter Clark Spotte-Smith, Ronald L Kam, Daniel Barter, Xiaowei Xie, Tingzheng Hou, Shyam Dwaraknath, Samuel M Blau, Kristin Aslaug Persson

Version 3 posted 16 March 2022

751

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Theoretical and Computational Chemistry

Working Paper

Protonation of the (6-4) lesion by histidine in DNA repair revisited

Tatiana Domratcheva, Konstantin Odintsov

Version 1 posted 12 December 2023

85

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Physical Chemistry

Working Paper

Applying Marcus Theory to Describe Photoluminescent Intermittency and Temperature Dependent Emission in CdTe Nanoplatelets

Xuanheng Tan, Tasnim Ahmed, Linus Murphy, Belle Coffey, Justin Caram

Version 1 posted 24 July 2024

138

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Theoretical and Computational Chemistry

Working Paper

Electron Tunneling Barriers in Marcus Theory of Electron Transfer: Incorporating Bridge State Thermal Fluctuations

Ravinder Kumar, Ravindra Venkatramani

Version 2 posted 07 May 2024

326

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Theoretical and Computational Chemistry

Working Paper

One-Electron Oxidation Potentials and Hole Delocalization in Heterogeneous Single-Stranded DNA

Jesús Lucia-Tamudo, Manuel Alcamí, Sergio Díaz-Tendero, Juan José Nogueira

Version 1 posted 20 June 2023

107

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Theoretical and Computational Chemistry

Working Paper

Modelling One-Electron Oxidation Potentials and Hole Delocalization in Double-Stranded DNA by Multilayer and Dynamic Approaches

Jesús Lucia-Tamudo, Sergio Díaz-Tendero, Juan Jose Nogueira

Version 1 posted 29 March 2024

141

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Physical Chemistry

Working Paper

Individual Marcus-type kinetics controls singlet and triplet oxygen evolution from superoxide

Soumyadip Mondal, Huyen T.K. Nguyen, Robert Hauschild, Stefan Freunberger

Version 1 posted 28 August 2024

201

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Refine Search

19 results in Marcus theory in Keywords: Marcus theory

Ideal Current-voltage Characteristics and Rectification Performance of Molecular Rectifier under Single Level based Tunneling and Hopping Transport

Applications of the Marcus cross relation to inner sphere O2 reduction: Implications in Small-Molecule Activation

Computation of Oxidation Potentials of Solvated Nucleobases by Static and Dynamic Multilayer Approaches

Towards a Mechanistic Model of Solid-Electrolyte Interphase Formation and Evolution in Lithium-ion Batteries

Protonation of the (6-4) lesion by histidine in DNA repair revisited

Applying Marcus Theory to Describe Photoluminescent Intermittency and Temperature Dependent Emission in CdTe Nanoplatelets

Electron Tunneling Barriers in Marcus Theory of Electron Transfer: Incorporating Bridge State Thermal Fluctuations

One-Electron Oxidation Potentials and Hole Delocalization in Heterogeneous Single-Stranded DNA

Modelling One-Electron Oxidation Potentials and Hole Delocalization in Double-Stranded DNA by Multilayer and Dynamic Approaches

Individual Marcus-type kinetics controls singlet and triplet oxygen evolution from superoxide

19 results in Keywords: Marcus theory