BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data
BEaTmap is an open-source software designed to improve the analysis of isothermal adsorption data. The specific surface area of a porous material is commonly obtained through applying the classic BET theory to the adsorption of inert gases and vapors in the relative pressure range of 5% to 35% and p...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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Ubiquity Press
2024-03-01
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| Series: | Journal of Open Research Software |
| Subjects: | |
| Online Access: | https://account.openresearchsoftware.metajnl.com/index.php/up-j-jors/article/view/403 |
| _version_ | 1797202780372336640 |
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| author | Ellsworth Bell David Morris Mohammad Amin Sadeghi Jeff Gostick |
| author_facet | Ellsworth Bell David Morris Mohammad Amin Sadeghi Jeff Gostick |
| author_sort | Ellsworth Bell |
| collection | DOAJ |
| description | BEaTmap is an open-source software designed to improve the analysis of isothermal adsorption data. The specific surface area of a porous material is commonly obtained through applying the classic BET theory to the adsorption of inert gases and vapors in the relative pressure range of 5% to 35% and presented as a single value. However, this cookie-cutter approach can yield thermodynamically inconsistent results that are incorrect or misleading. BEaTmap provides a conceptual tool for analyzing the entire set of isothermal adsorption data with BET theory and presents the range of all possible values that are thermodynamically and mathematically consistent. The analysis is presented as a heatmap indicating the results for all valid relative pressure ranges, offering the user a more comprehensive specific surface area answer. The code is written in Python and is available as both a web app and Python package. BEaTmap, documentation, and examples are freely available on GitHub. |
| first_indexed | 2024-04-24T08:08:52Z |
| format | Article |
| id | doaj.art-06f60402e6b641b0ac73a2deb88f4ca4 |
| institution | Directory Open Access Journal |
| issn | 2049-9647 |
| language | English |
| last_indexed | 2024-04-24T08:08:52Z |
| publishDate | 2024-03-01 |
| publisher | Ubiquity Press |
| record_format | Article |
| series | Journal of Open Research Software |
| spelling | doaj.art-06f60402e6b641b0ac73a2deb88f4ca42024-04-17T06:48:18ZengUbiquity PressJournal of Open Research Software2049-96472024-03-011215510.5334/jors.403434BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption DataEllsworth Bell0https://orcid.org/0000-0003-1314-9958David Morris1https://orcid.org/0000-0001-5872-2880Mohammad Amin Sadeghi2https://orcid.org/0000-0002-6756-9117Jeff Gostick3https://orcid.org/0000-0001-7736-7124Department of Chemical Engineering, University of Waterloo, Waterloo, ONDepartment of Chemical Engineering, McGill University, Montreal, QCDepartment of Chemical Engineering, University of Waterloo, Waterloo, ONDepartment of Chemical Engineering, University of Waterloo, Waterloo, ONBEaTmap is an open-source software designed to improve the analysis of isothermal adsorption data. The specific surface area of a porous material is commonly obtained through applying the classic BET theory to the adsorption of inert gases and vapors in the relative pressure range of 5% to 35% and presented as a single value. However, this cookie-cutter approach can yield thermodynamically inconsistent results that are incorrect or misleading. BEaTmap provides a conceptual tool for analyzing the entire set of isothermal adsorption data with BET theory and presents the range of all possible values that are thermodynamically and mathematically consistent. The analysis is presented as a heatmap indicating the results for all valid relative pressure ranges, offering the user a more comprehensive specific surface area answer. The code is written in Python and is available as both a web app and Python package. BEaTmap, documentation, and examples are freely available on GitHub.https://account.openresearchsoftware.metajnl.com/index.php/up-j-jors/article/view/403betspecific surface areapythonadsorptionisotherm |
| spellingShingle | Ellsworth Bell David Morris Mohammad Amin Sadeghi Jeff Gostick BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data Journal of Open Research Software bet specific surface area python adsorption isotherm |
| title | BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data |
| title_full | BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data |
| title_fullStr | BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data |
| title_full_unstemmed | BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data |
| title_short | BEaTmap: Simplified Rigorous BET Analysis of Isothermal Adsorption Data |
| title_sort | beatmap simplified rigorous bet analysis of isothermal adsorption data |
| topic | bet specific surface area python adsorption isotherm |
| url | https://account.openresearchsoftware.metajnl.com/index.php/up-j-jors/article/view/403 |
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