Reassessment of vibration spectra in alkali phosphate crystals
نویسندگان
چکیده
The Raman and infrared (IR) spectra for the alkali metaphosphate crystals composed of Q2 units pyrophosphate crystal Q1 were assessed by density functional theory calculations. assignments peaks calculated IR consistent with reported phosphate glasses except assignment around 1100 cm?1 crystals. Peaks have been assigned to asymmetric stretching vibrations bonds between phosphorus atoms non-bridging oxygens (NBO) units. However, showed that result from not only P–NBO but also symmetric –P–O–P–
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ژورنال
عنوان ژورنال: Journal of the Ceramic Society of Japan
سال: 2022
ISSN: ['1882-0743', '1348-6535']
DOI: https://doi.org/10.2109/jcersj2.21180