The analysis of HF molecule by means of infrared transitions in H + F2 collinear scattering on two different potential energy surfaces

dc.contributor.author	Karabulut, E.
dc.contributor.author	Sidir, İ.
dc.date.accessioned	2021-12-16T10:12:06Z
dc.date.available	2021-12-16T10:12:06Z
dc.date.issued	2018
dc.identifier.issn	92614
dc.identifier.uri	https://doi.org/10.1016/j.cplett.2018.08.050
dc.identifier.uri	http://dspace.beu.edu.tr:8080/xmlui/handle/20.500.12643/12983
dc.description.abstract	In this study, infrared vibrational modes and intensities are calculated for F2 + H → HF + F reaction according to distance between F and H atoms by using DFT-B3LYP/6-311++G (d, p) level of theory. Also for the relevant reaction, the vibrational energy ei
dc.description.sponsorship	Türkiye Bilimsel ve Teknolojik Araştirma Kurumu, TÜBITAK; Bitlis Eren Üniversitesi, BEU
dc.language.iso	English
dc.publisher	Elsevier B.V.
dc.source	Chemical Physics Letters
dc.title	The analysis of HF molecule by means of infrared transitions in H + F2 collinear scattering on two different potential energy surfaces
dc.type	Article
dc.identifier.startpage	103
dc.identifier.endpage	109
dc.identifier.doi	10.1016/j.cplett.2018.08.050
dc.identifier.scopus	2-s2.0-85052158850
dc.identifier.volume	709

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