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All paths lead to hubs in the spectroscopic networks of water isotopologues H216O and H218O.
Tóbiás, Roland; Diouf, Meissa L; Cozijn, Frank M J; Ubachs, Wim; Császár, Attila G.
Afiliación
  • Tóbiás R; Laboratory of Molecular Structure and Dynamics, Institute of Chemistry, ELTE Eötvös Loránd University and HUN-REN-ELTE Complex Chemical Systems Research Group, H-1117 Budapest, Pázmány Péter sétány 1/A, Hungary.
  • Diouf ML; Department of Physics and Astronomy, LaserLaB, Vrije Universiteit, De Boelelaan 1081, 1081 HV, Amsterdam, The Netherlands.
  • Cozijn FMJ; Department of Physics and Astronomy, LaserLaB, Vrije Universiteit, De Boelelaan 1081, 1081 HV, Amsterdam, The Netherlands.
  • Ubachs W; Department of Physics and Astronomy, LaserLaB, Vrije Universiteit, De Boelelaan 1081, 1081 HV, Amsterdam, The Netherlands. w.m.g.ubachs@vu.nl.
  • Császár AG; Laboratory of Molecular Structure and Dynamics, Institute of Chemistry, ELTE Eötvös Loránd University and HUN-REN-ELTE Complex Chemical Systems Research Group, H-1117 Budapest, Pázmány Péter sétány 1/A, Hungary. attila.csaszar@ttk.elte.hu.
Commun Chem ; 7(1): 34, 2024 Feb 16.
Article en En | MEDLINE | ID: mdl-38365971
ABSTRACT
Network theory has fundamentally transformed our comprehension of complex systems, catalyzing significant advances across various domains of science and technology. In spectroscopic networks, hubs are the quantum states involved in the largest number of transitions. Here, utilizing network paths probed via precision metrology, absolute energies have been deduced, with at least 10-digit accuracy, for almost 200 hubs in the experimental spectroscopic networks of H216O and H218O. These hubs, lying on the ground vibrational states of both species and the bending fundamental of H216O, are involved in tens of thousands of observed transitions. Relying on the same hubs and other states, benchmark-quality line lists have been assembled, which supersede and improve, by three orders of magnitude, the accuracy of the massive amount of data reported in hundreds of papers dealing with Doppler-limited spectroscopy. Due to the omnipresence of water, these ultraprecise line lists could be applied to calibrate high-resolution spectra and serve ongoing and upcoming space missions.

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Commun Chem Año: 2024 Tipo del documento: Article País de afiliación: Hungria

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Commun Chem Año: 2024 Tipo del documento: Article País de afiliación: Hungria