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A Transition State Theory-Based Continuum Plasticity Model Accounting for the Local Stress Fluctuation

• Authors : Yongjia Zheng; Hongwei Wang; Xiangyu Zhou

Subjects: transition state theory; continuum plasticity; dislocation density

• Source: Metals, Vol 14, Iss 11, p 1228 (2024)

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Applicability of Transition State Theory to the (Proton-Coupled) Electron Transfer in Photosynthetic Water Oxidation with Emphasis on the Entropy of Activation

• Authors : Dau, Holger; Greife, Paul

Subjects: photosystem II; oxygen evolution reaction; proton-coupled electron transfer

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Applicability of Transition State Theory to the (Proton-Coupled) Electron Transfer in Photosynthetic Water Oxidation with Emphasis on the Entropy of Activation

• Authors : Holger Dau; Paul Greife

Subjects: photosystem II; oxygen evolution reaction; proton-coupled electron transfer

• Source: Inorganics, Vol 11, Iss 389, p 389 (2023)

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On-The-Fly Kinetics of the Hydrogen Abstraction by Hydroperoxyl Radical: An Application of the Reaction Class Transition State Theory

• Authors : Maciej Baradyn; Artur Ratkiewicz

Subjects: reaction class transition state theory; hydroperoxyl radical; quantum tunneling composite

• Source: Frontiers in Chemistry, Vol 9 (2022)

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Enhancing Eyringpy: Accurate Rate Constants with Canonical Variational Transition State Theory and the Hindered Rotor Model

• Authors : Dzib, Eugenia; Quintal, Alan; Merino, Gabriel ...

• Source: Journal of Chemical Theory and Computation ; volume 20, issue 22, page 9999-10009 ; ISSN 1549-9618 1549-9626

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Modelling kinetic isotope effects for Swern oxidation using DFT-based transition state theory

• Authors : Braddock, D. Christopher; Lee, Siwoo; Rzepa, Henry S.

• Source: Digital Discovery ; volume 3, issue 8, page 1496-1508 ; ISSN 2635-098X

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Creep deformation in metallic glasses: A global approach with strain as an indicator within transition state theory

• Authors : Zhang, L.T.; Wang, Y.J.; Nabahat, M. ...

• Source: International Journal of Plasticity ; volume 174, page 103923 ; ISSN 0749-6419

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Transition-state theory reexamined

• Authors : Weidenmüller, Hans A.

• Source: Physical Review E ; volume 109, issue 3 ; ISSN 2470-0045 2470-0053

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The Limitation of the Combination of Transition State Theory and Thermodynamics for the Reactions of Proteins and Nucleic Acids

• Authors : Nobuo Shimamoto

Subjects: chemical ratchet; kinetics; reaction theoryagris

• Source: Biomolecules; Volume 12; Issue 1; Pages: 28

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The Limitation of the Combination of Transition State Theory and Thermodynamics for the Reactions of Proteins and Nucleic Acids

• Authors : Nobuo Shimamoto

Subjects: chemical ratchet; kinetics; reaction theory

• Source: Biomolecules, Vol 12, Iss 28, p 28 (2021)

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