Vetting molecular candidates posited for the first diffuse interstellar bands (5780 and 5797 Å): a quantum chemical study.

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Title: Vetting molecular candidates posited for the first diffuse interstellar bands (5780 and 5797 Å): a quantum chemical study.
Authors: Seuret H; Centro de Investigaciones Químicas, IICBA, Universidad Autónoma del Estado de Morelos, Cuernavaca, 62209, Morelos, México.; Department of Chemistry and Physics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. daniel.majaess@gmail.com., Sullivan AD; Department of Chemistry and Physics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. daniel.majaess@gmail.com., Morera-Boado C; Departamento de Físicoquímica Teórica, Secihti-Centro de Investigaciones Químicas, IICBA, Universidad Autónoma del Estado de Morelos, Cuernavaca, 62209, Morelos, México. cercis.morerab@uaem.edu.mx., Harriott TA; Department of Chemistry and Physics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. daniel.majaess@gmail.com.; Department of Mathematics and Statistics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. Tina.Harriott@msvu.ca., Majaess D; Department of Chemistry and Physics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. daniel.majaess@gmail.com.; Department of Mathematics and Statistics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. Tina.Harriott@msvu.ca., Massa L; Hunter College & the PhD Program of the Graduate Center, City University of New York, New York, NY 10065, USA., Matta CF; Department of Chemistry and Physics, Mount Saint Vincent University, Halifax, Nova Scotia, B3M2J6, Canada. daniel.majaess@gmail.com.; Department of Chemistry, Saint Mary's University, Halifax, Nova Scotia, B3H3C3, Canada.; Département de Chimie, Université Laval, Québec, Québec, G1V 0A6, Canada.
Source: Physical chemistry chemical physics : PCCP [Phys Chem Chem Phys] 2025 Jun 18; Vol. 27 (24), pp. 12666-12674. Date of Electronic Publication: 2025 Jun 18.
Publication Type: Journal Article
Journal Info: Publisher: Royal Society of Chemistry Country of Publication: England NLM ID: 100888160 Publication Model: Electronic Cited Medium: Internet ISSN: 1463-9084 (Electronic) Linking ISSN: 14639076 NLM ISO Abbreviation: Phys Chem Chem Phys Subsets: MEDLINE; PubMed not MEDLINE
Database: MEDLINE Ultimate
Description
ISSN:1463-9084
DOI:10.1039/d4cp04023f