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Effects of temperature on D2O water structure investigated by Raman spectroscopy

机译:拉曼光谱研究温度对D2O水结构的影响

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摘要

In situ Raman spectroscopy is employed to study the effects of temperature on D2O water structure up to 573K at 10MPa. With increasing temperature, the O-D stretching band moves to the higher wavenumber, implying that higher temperature can result in the break of hydrogen bonding. According to the discussion on the liquid water structure and from the van 't Hoff equation, the hydrogen bond energy of D2O is calculated to be 2.50 +/- 0.3 kcal/mol.
机译:用原位拉曼光谱法研究温度对10MPa下最高573K的D2O水结构的影响。随着温度升高,O-D拉伸带移至更高的波数,这意味着更高的温度可能导致氢键断裂。根据对液态水结构的讨论并根据van't Hoff方程,D2O的氢键能计算为2.50 +/- 0.3 kcal / mol。

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