Articles with "rotational spectra" as a keyword



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VMS-ROT: A New Module of the Virtual Multifrequency Spectrometer for Simulation, Interpretation, and Fitting of Rotational Spectra

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Published in 2017 at "Journal of Chemical Theory and Computation"

DOI: 10.1021/acs.jctc.7b00533

Abstract: The Virtual Multifrequency Spectrometer (VMS) is a tool that aims at integrating a wide range of computational and experimental spectroscopic techniques with the final goal of disclosing the static and dynamic physical–chemical properties “hidden” in… read more here.

Keywords: interpretation; module; vms rot; spectroscopy ... See more keywords
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Internal methyl rotation and molecular structure of trifluorotoluenes: microwave rotational spectra of 2,3,4- and 2,4,5-trifluorotoluene

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Published in 2020 at "Canadian Journal of Physics"

DOI: 10.1139/cjp-2019-0477

Abstract: The microwave rotational spectra of 2,3,4- and 2,4,5-trifluorotoluenes, along with all 13C isotopic species in natural abundance, have been recorded in the frequency range 8–27 GHz employing pulsed... read more here.

Keywords: methyl rotation; molecular structure; internal methyl; microwave rotational ... See more keywords