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Raman spectra of chondrodite at various temperatures
Author(s) -
Mernagh Terrence P.,
Liu Lingun,
Lin C.C.
Publication year - 1999
Publication title -
journal of raman spectroscopy
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.748
H-Index - 110
eISSN - 1097-4555
pISSN - 0377-0486
DOI - 10.1002/(sici)1097-4555(199910)30:10<963::aid-jrs484>3.0.co;2-d
Subject(s) - raman spectroscopy , anharmonicity , wavenumber , chemistry , spectral line , atmospheric pressure , atmospheric temperature range , analytical chemistry (journal) , molecular vibration , thermodynamics , optics , condensed matter physics , geology , organic chemistry , physics , oceanography , astronomy
The effect of temperature on the Raman spectra of natural and synthetic chondrodite was investigated over the range 81 to 873 K at atmospheric pressure. All samples remained intact up to 873 K. This high‐temperature stability is unusual, and contrasts with the behaviour of all other synthetic dense hydrous magnesium silicates which have, so far, been found to dehydrate at temperatures below 873 K at atmospheric pressure. Also, unlike the other dense hydrous magnesium silicates, the Raman‐active OH‐stretching bands of both natural and synthetic chondrodite were observed to decrease in wavenumber with increasing temperature. The negative temperature dependence of these vibrations suggests that there is a rather open environment around the OH bonds. All the Raman‐active modes below 1000 cm −1 (except the 571 cm −1 band in synthetic, F‐free, chondrodite) have a negative temperature dependence in accord with most other silicates. The temperature data, combined with published high‐pressure data, were also used to determine the intrinsic anharmonicity of the Raman‐active modes. Synthetic chondrodite was found to have smaller intrinsic anharmonic parameters ( a i ) than natural chondrodite. Comparison of the OH‐stretching modes with the internal modes of synthetic chondrodite showed that they were similar but had opposite behaviour, while the internal modes of natural chondrodite were found to have much larger a i parameters. The modes at 931 and 966 cm −1 in natural chondrodite had the highest levels of intrinsic anharmonicity indicating that they may arise from SiOH vibrations rather than SiO 4 vibrations. The larger temperature dependence of the Raman‐active modes and the higher intrinsic anharmonicity of natural chondrodite indicate that the presence of fluorine atoms has a strong influence on the vibrational properties of chondrodite and the OH vibrations in particular. Copyright © 1999 John Wiley & Sons, Ltd.