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Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy

[Image: see text] Structural disorder in molecular crystals is a fundamental limitation for achieving high charge carrier mobilities. Quantifying and uncovering the mechanistic origins of disorder are, however, extremely challenging. Here we use variable coherence transmission electron microscopy to...

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Autores principales: Alanazi, F., Eggeman, A. S., Stavrou, K., Danos, A., Monkman, A. P., Mendis, B. G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10510430/
https://www.ncbi.nlm.nih.gov/pubmed/37671926
http://dx.doi.org/10.1021/acs.jpclett.3c01344
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author Alanazi, F.
Eggeman, A. S.
Stavrou, K.
Danos, A.
Monkman, A. P.
Mendis, B. G.
author_facet Alanazi, F.
Eggeman, A. S.
Stavrou, K.
Danos, A.
Monkman, A. P.
Mendis, B. G.
author_sort Alanazi, F.
collection PubMed
description [Image: see text] Structural disorder in molecular crystals is a fundamental limitation for achieving high charge carrier mobilities. Quantifying and uncovering the mechanistic origins of disorder are, however, extremely challenging. Here we use variable coherence transmission electron microscopy to analyze disorder in tri-isopropyl silane pentacene films, utilizing diffuse scattering that is present both as linear streaks and as a slowly varying, isotropic background. The former is due to thermal vibration of the pentacene molecules along their long axis, while the latter is due to static defects kinetically frozen during film deposition. The thermal vibrational amplitude is ∼0.4 Å, while the static displacement parameter in our simplified analysis is much larger (1.0 Å), because it represents the cumulative scattering of all defect configurations that are frozen in the film. Thin film fabrication therefore has an important effect on crystallinity; our technique can be readily used to compare samples prepared under different conditions.
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spelling pubmed-105104302023-09-21 Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy Alanazi, F. Eggeman, A. S. Stavrou, K. Danos, A. Monkman, A. P. Mendis, B. G. J Phys Chem Lett [Image: see text] Structural disorder in molecular crystals is a fundamental limitation for achieving high charge carrier mobilities. Quantifying and uncovering the mechanistic origins of disorder are, however, extremely challenging. Here we use variable coherence transmission electron microscopy to analyze disorder in tri-isopropyl silane pentacene films, utilizing diffuse scattering that is present both as linear streaks and as a slowly varying, isotropic background. The former is due to thermal vibration of the pentacene molecules along their long axis, while the latter is due to static defects kinetically frozen during film deposition. The thermal vibrational amplitude is ∼0.4 Å, while the static displacement parameter in our simplified analysis is much larger (1.0 Å), because it represents the cumulative scattering of all defect configurations that are frozen in the film. Thin film fabrication therefore has an important effect on crystallinity; our technique can be readily used to compare samples prepared under different conditions. American Chemical Society 2023-09-06 /pmc/articles/PMC10510430/ /pubmed/37671926 http://dx.doi.org/10.1021/acs.jpclett.3c01344 Text en © 2023 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by/4.0/Permits the broadest form of re-use including for commercial purposes, provided that author attribution and integrity are maintained (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Alanazi, F.
Eggeman, A. S.
Stavrou, K.
Danos, A.
Monkman, A. P.
Mendis, B. G.
Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy
title Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy
title_full Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy
title_fullStr Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy
title_full_unstemmed Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy
title_short Quantifying Molecular Disorder in Tri-Isopropyl Silane (TIPS) Pentacene Using Variable Coherence Transmission Electron Microscopy
title_sort quantifying molecular disorder in tri-isopropyl silane (tips) pentacene using variable coherence transmission electron microscopy
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10510430/
https://www.ncbi.nlm.nih.gov/pubmed/37671926
http://dx.doi.org/10.1021/acs.jpclett.3c01344
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