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Materials Chemistry

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Dynamic Disorder

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4 results in Keywords: Dynamic Disorder

Materials Chemistry

Elucidating the germanium distribution in ITQ-13 zeolites by density functional theory

Michael Fischer, Carlos Bornes, Luís Mafra, João Rocha

Version 2 posted 18 January 2022

260

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Materials Science

Anharmonic Origin of Giant Thermal Displacements in the Metal-Organic Framework UiO-67

Katrine Svane, Jessica Bristow, Aron Walsh

Version 1 posted 15 September 2017

738

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Materials Chemistry

Untangling the Fundamental Electronic Origins of Non-Local Electron-Phonon Coupling in Organic Semiconductors

Peter Banks, Gabriele D'Avino, Guillaume Schweicher, Jeff Armstrong, Chrisitian Ruzie, Jong Won Chung, Chizuru Sawabe, Jeong-Il Park, Toshihiro Okamoto, Jun Takeya, Henning Sirringhaus, Michael Ruggiero

Version 1 posted 05 April 2023

269

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Materials Chemistry

Revisiting the structure of calcined and hydrated AlPO-11 with DFT-based molecular dynamics simulations

Michael Fischer

Version 1 posted 01 July 2021

280

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