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Theoretical and Computational Chemistry

Working Paper

A Hydrogen Bond Between Linear Tetrapyrrole and Conserved Aspartate Causes the Far-Red Shifted Absorption of Phytochrome Photoreceptors

Egle Maximowitsch, Tatiana Domratcheva

Version 1 posted 12 May 2020

365

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3

Citations

Theoretical and Computational Chemistry

Working Paper

2D-Map of Intermolecular Interactions in Organic Chemistry Reveals Underrepresented Area of Research

Hao Su, Xuepeng Zhang, Guoqing Zhang

Version 1 posted 24 February 2021

344

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Theoretical and Computational Chemistry

Working Paper

Electron Transfer of Functionalised Quinones in Acetonitrile

Tzu-Yao Hsu, Roxanne Berthin, Alessandra Serva, Kyle Reeves, Mathieu Salanne, Guillaume Jeanmairet

Version 1 posted 13 June 2022

196

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Physical Chemistry

Working Paper

Efficient analytical gradients of property-based diabatic states: Geometry optimizations for localized holes

Amiel Paz, William Glover

Version 1 posted 15 March 2023

142

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Energy

Working Paper

A new generation high-performance supercapacitor engaging redox property of solvent-electrolyte (Ionic Liquid)

Preeti Jain, Palak Mehra, Amit Paul

Version 1 posted 23 June 2022

241

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Catalysis

Working Paper

From light to hydrogen: the complete life cycle of free charges in organic photocatalytic nanoparticles

Jessica de la Perrelle, Rohan Hudson, Andrew Dolan, Sanjib Jana, Xun Pan, Mats Andersson, Howe-Siang Tan, Trevor Smith, David Huang, Tak W. Kee

Version 1 posted 27 September 2023

181

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Theoretical and Computational Chemistry

Working Paper

Simulations of DNA-coordinated light emission vs. intramolecular electron transfer: electron donor-acceptor systems with benzo[a]pyrene derivatives

Widana Kaushalya, Alice Walker

Version 1 posted 30 August 2023

58

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Physical Chemistry

Working Paper

Grand canonical rate theory for electrochemical and electrocatalytic systems I: General formulation and proton-coupled electron transfer reactions

Marko Melander

Version 5 posted 12 June 2020

2,178

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Inorganic Chemistry

Working Paper

Unusually Strong Long-range Electronic Coupling Across Redox-Active Bridges in M3+/M4+ Mixed-Valence Complexes of Group 4 Congeners

Colby Seth Bell, Nathan J. DeYonker, Curtis E. Moore, Kensha Marie Clark

Version 1 posted 09 July 2021

464

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Theoretical and Computational Chemistry

Working Paper

ELECTRON TRANSFER NETWORKS

Harry Gray

Version 1 posted 16 May 2022

344

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65 results in Electron transfer in Keywords: Electron transfer

A Hydrogen Bond Between Linear Tetrapyrrole and Conserved Aspartate Causes the Far-Red Shifted Absorption of Phytochrome Photoreceptors

2D-Map of Intermolecular Interactions in Organic Chemistry Reveals Underrepresented Area of Research

Electron Transfer of Functionalised Quinones in Acetonitrile

Efficient analytical gradients of property-based diabatic states: Geometry optimizations for localized holes

A new generation high-performance supercapacitor engaging redox property of solvent-electrolyte (Ionic Liquid)

From light to hydrogen: the complete life cycle of free charges in organic photocatalytic nanoparticles

Simulations of DNA-coordinated light emission vs. intramolecular electron transfer: electron donor-acceptor systems with benzo[a]pyrene derivatives

Grand canonical rate theory for electrochemical and electrocatalytic systems I: General formulation and proton-coupled electron transfer reactions

Unusually Strong Long-range Electronic Coupling Across Redox-Active Bridges in M3+/M4+ Mixed-Valence Complexes of Group 4 Congeners

ELECTRON TRANSFER NETWORKS

65 results in Keywords: Electron transfer