Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules

Quartz crystal resonators coated with gas-sorptive films were characterized by analyzing their structures and their organic gas-sorption behaviors, which were then studied using statistics and computational molecular simulations. The films had carbonaceous structures that were prepared by radio-freq...

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Main Authors: Iwao Sugimoto, Yoriko Suda, Kazuhiko Takahashi
Format: Article
Language:English
Published: Elsevier 2022-01-01
Series:Results in Chemistry
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S221171562200145X
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author Iwao Sugimoto
Yoriko Suda
Kazuhiko Takahashi
author_facet Iwao Sugimoto
Yoriko Suda
Kazuhiko Takahashi
author_sort Iwao Sugimoto
collection DOAJ
description Quartz crystal resonators coated with gas-sorptive films were characterized by analyzing their structures and their organic gas-sorption behaviors, which were then studied using statistics and computational molecular simulations. The films had carbonaceous structures that were prepared by radio-frequency (rf) sputtering of aromatic biomolecules, such as cytosine and lignin. These films had been compared with the rf-sputtered films of hydrophilic biopolymer of lignin and gelatin.The composition and morphology of each film governed the organic gas-sorption characteristics of the resonator sensors used for organic gas-sensing. The cytosine film, which was nitrogen-rich and layered, had a moderate affinity for the larger molecules of normal alcohols and acetate esters. The cytosine film is repulsive to positively-charged moieties of adsorbates. In contrast, the agarose film, which was nitrogen-poor and columnar, had a high affinity for small adsorbates with short hydrocarbon chains. Molecular flexibility of the adsorbate played an important role in the gas-sorption ability of the agarose film. Molecular dynamics simulation clarified that the weakly dipolar adsorbate-aggregate were immiscible in the cytosine adsorbent-aggregate because the collision mixture was prone to be instable. In practice, the cytosine-sputtered film had a higher gas-sorption ability for weakly dipolar species that have the longer hydrocarbon chains.
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spelling doaj.art-015de7f83d57407293a06452a3861cfe2022-12-22T04:22:28ZengElsevierResults in Chemistry2211-71562022-01-014100426Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomoleculesIwao Sugimoto0Yoriko Suda1Kazuhiko Takahashi2School of Computer Science, Tokyo University of Technology, 1404-1 Katakura, Hachioji, Tokyo 192-0982, Japan; Corresponding author.School of Computer Science, Tokyo University of Technology, 1404-1 Katakura, Hachioji, Tokyo 192-0982, JapanDepartment of Systems Design, Faculty of Science and Engineering, Doshisha University, 1-3 Miyakodani Tatara, Kyotanabe, Kyoto 610-0321, JapanQuartz crystal resonators coated with gas-sorptive films were characterized by analyzing their structures and their organic gas-sorption behaviors, which were then studied using statistics and computational molecular simulations. The films had carbonaceous structures that were prepared by radio-frequency (rf) sputtering of aromatic biomolecules, such as cytosine and lignin. These films had been compared with the rf-sputtered films of hydrophilic biopolymer of lignin and gelatin.The composition and morphology of each film governed the organic gas-sorption characteristics of the resonator sensors used for organic gas-sensing. The cytosine film, which was nitrogen-rich and layered, had a moderate affinity for the larger molecules of normal alcohols and acetate esters. The cytosine film is repulsive to positively-charged moieties of adsorbates. In contrast, the agarose film, which was nitrogen-poor and columnar, had a high affinity for small adsorbates with short hydrocarbon chains. Molecular flexibility of the adsorbate played an important role in the gas-sorption ability of the agarose film. Molecular dynamics simulation clarified that the weakly dipolar adsorbate-aggregate were immiscible in the cytosine adsorbent-aggregate because the collision mixture was prone to be instable. In practice, the cytosine-sputtered film had a higher gas-sorption ability for weakly dipolar species that have the longer hydrocarbon chains.http://www.sciencedirect.com/science/article/pii/S221171562200145XQuartz crystal resonatorRadio-frequency sputteringQuantitative structure property relationshipLinear solvation energy relationshipMolecular dynamics
spellingShingle Iwao Sugimoto
Yoriko Suda
Kazuhiko Takahashi
Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules
Results in Chemistry
Quartz crystal resonator
Radio-frequency sputtering
Quantitative structure property relationship
Linear solvation energy relationship
Molecular dynamics
title Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules
title_full Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules
title_fullStr Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules
title_full_unstemmed Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules
title_short Physicochemical and statistical characterization of gas-sensing behaviors of resonator sensors with carbonaceous films prepared by rf-sputtering of aromatic and hydrophilic biomolecules
title_sort physicochemical and statistical characterization of gas sensing behaviors of resonator sensors with carbonaceous films prepared by rf sputtering of aromatic and hydrophilic biomolecules
topic Quartz crystal resonator
Radio-frequency sputtering
Quantitative structure property relationship
Linear solvation energy relationship
Molecular dynamics
url http://www.sciencedirect.com/science/article/pii/S221171562200145X
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AT kazuhikotakahashi physicochemicalandstatisticalcharacterizationofgassensingbehaviorsofresonatorsensorswithcarbonaceousfilmspreparedbyrfsputteringofaromaticandhydrophilicbiomolecules