Revealing SO 2 and CO 2 adsorption features on forsterite via IR spectroscopy and automated computational approaches
Year: 2025
Type: article
Abstract: , our simulations identify the dominant bands due to bidentate and tridentate chemisorption. This integrative approach highlights the importance of surface morphology and thermodynamic weighting in reconciling theory and experiments providing a framework for the spectroscopic analysis of molecular adsorption on interstellar dust analogs.
DOI: 10.1039/d5cp01699a
Language: English
Subfield: Astronomy and Astrophysics
Field: Physics and Astronomy
Domain: Physical Sciences
Open Access status: hybrid
Funders: European High Performance Computing Joint Undertaking, Ministerio de Ciencia, Innovación y Universidades, Dipartimenti di Eccellenza, European Commission, Partnership for Advanced Computing in Europe AISBL, Institució Catalana de Recerca i Estudis Avançats, Agenzia Spaziale Italiana, Ministero dell'Università e della Ricerca, H2020 European Research Council, Ministerio de Universidades, NextGenerationEU
OpenAlex ID: W4410944358
