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Near-Infrared Spectra of High-Density Crystalline H<sub>2</sub>O Ices II, IV, V, VI, IX, and XII

Christina M. Tonauer, Eva‐Maria Köck, Tobias M. Gasser, Violeta Fuentes-Landete, Raphael Henn, Sophia Mayr, Christian G. Kirchler, Christian W. Huck, Thomas Loerting

2021The Journal of Physical Chemistry A14 citationsDOIOpen Access PDF

Abstract

. By contrast to earlier work, we do not use mulling agents or transmission of thin films but use diffuse reflectance on powdered samples in liquid nitrogen. The first overtone of the OH-stretching mode is identified as the marker band most suitable to distinguish between these ices. There is a clear blue shift of this band that increases with increasing topological density in addition to a significant narrowing of the band.

Topics & Concepts

Spectral lineInfrared spectroscopyOvertoneInfraredChemistryCrystallographyBand gapHydrogen bondNitrogenMaterials scienceAnalytical Chemistry (journal)PhysicsMoleculeOpticsOptoelectronicsOrganic chemistryAstronomyMethane Hydrates and Related PhenomenaHigh-pressure geophysics and materialsGlass properties and applications
Near-Infrared Spectra of High-Density Crystalline H<sub>2</sub>O Ices II, IV, V, VI, IX, and XII | Litcius