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rate constant

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7 results in Keywords: rate constant

Chemistry

Working Paper

Studying Kinetics of a Surface Reaction using Elastocapillary Effect

Nitish Singh, Ajeet Kumar, Animangsu Ghatak

Version 1 posted 20 March 2023

147

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Chemistry

Working Paper

A Model of Pre-reaction Complexes

YILMAZ OZKILIC

Version 2 posted 28 August 2023

101

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Chemistry

Working Paper

A simplified Bixon-Jortner-Plotnikov method for fast calculation of radiationless transfer rates in symmetric molecules

Arthur I. Martynov, Aleksandr S. Belov, Vladimir K. Nevolin

Version 1 posted 16 December 2022

125

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Chemistry

Working Paper

Theoretical Determination of Rate Constants from Excited-States: Application to Benzophenone

Katsuyuki Shizu, Hironori Kaji

Version 1 posted 24 May 2021

1,224

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Chemistry

Working Paper

An energy decomposition and extrapolation scheme for evaluating electron transfer rate constants: A case study on electron self-exchange reactions of transition metal complexes

Akihiro Mutsuji, Kenichiro Saita, Satoshi Maeda

Version 1 posted 30 June 2022

157

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Chemistry

Working Paper

Structure-Based Reaction Descriptors for Predicting Rate Constants by Machine Learning: Application to Hydrogen Abstraction from Alkanes by CH3/H/O Radicals

Yu Zhang, Jinhui Yu, Hongwei Song, Minghui Yang

Version 1 posted 30 May 2023

101

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Chemistry

Working Paper

Using non-adiabatic excitation transfer for signal transmission between molecular logic gates

Arthur I. Martynov, Aleksandr S. Belov

Version 1 posted 04 August 2023

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7 results in rate constant in Keywords: rate constant

Studying Kinetics of a Surface Reaction using Elastocapillary Effect

A Model of Pre-reaction Complexes

A simplified Bixon-Jortner-Plotnikov method for fast calculation of radiationless transfer rates in symmetric molecules

Theoretical Determination of Rate Constants from Excited-States: Application to Benzophenone

An energy decomposition and extrapolation scheme for evaluating electron transfer rate constants: A case study on electron self-exchange reactions of transition metal complexes

Structure-Based Reaction Descriptors for Predicting Rate Constants by Machine Learning: Application to Hydrogen Abstraction from Alkanes by CH3/H/O Radicals

Using non-adiabatic excitation transfer for signal transmission between molecular logic gates

7 results in Keywords: rate constant