Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances

[Image: see text] The modified smooth exterior scaling (MSES) method is applied for the first time to calculate the energy and the width of the electron-molecule scattering. The isoelectronic (2)Π(g) N(2)(–) and (2)Π CO(–) shape resonances have been studied as a test case for the MSES method. The re...

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Autores principales: Banuary, Mwdansar, Gupta, Ashish Kumar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9948208/
https://www.ncbi.nlm.nih.gov/pubmed/36844516
http://dx.doi.org/10.1021/acsomega.3c00033
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author Banuary, Mwdansar
Gupta, Ashish Kumar
author_facet Banuary, Mwdansar
Gupta, Ashish Kumar
author_sort Banuary, Mwdansar
collection PubMed
description [Image: see text] The modified smooth exterior scaling (MSES) method is applied for the first time to calculate the energy and the width of the electron-molecule scattering. The isoelectronic (2)Π(g) N(2)(–) and (2)Π CO(–) shape resonances have been studied as a test case for the MSES method. The results obtained using this method are in good agreement with experimental results. The conventional smooth exterior scaling (SES) method with different paths has also been applied for comparison purposes.
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spelling pubmed-99482082023-02-24 Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances Banuary, Mwdansar Gupta, Ashish Kumar ACS Omega [Image: see text] The modified smooth exterior scaling (MSES) method is applied for the first time to calculate the energy and the width of the electron-molecule scattering. The isoelectronic (2)Π(g) N(2)(–) and (2)Π CO(–) shape resonances have been studied as a test case for the MSES method. The results obtained using this method are in good agreement with experimental results. The conventional smooth exterior scaling (SES) method with different paths has also been applied for comparison purposes. American Chemical Society 2023-02-09 /pmc/articles/PMC9948208/ /pubmed/36844516 http://dx.doi.org/10.1021/acsomega.3c00033 Text en © 2023 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by-nc-nd/4.0/Permits non-commercial access and re-use, provided that author attribution and integrity are maintained; but does not permit creation of adaptations or other derivative works (https://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Banuary, Mwdansar
Gupta, Ashish Kumar
Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances
title Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances
title_full Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances
title_fullStr Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances
title_full_unstemmed Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances
title_short Application of Modified Smooth Exterior Scaling Method to Study (2)Π(g) N(2)(–) and (2)Π CO(–) Shape Resonances
title_sort application of modified smooth exterior scaling method to study (2)π(g) n(2)(–) and (2)π co(–) shape resonances
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9948208/
https://www.ncbi.nlm.nih.gov/pubmed/36844516
http://dx.doi.org/10.1021/acsomega.3c00033
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