Temperature and polarization dependent Raman spectra of liquid H2O and D2O

被引:30
作者
Pattenaude, Shannon R. [1 ]
Streacker, Louis M. [1 ]
Ben-Amotz, Dor [1 ]
机构
[1] Purdue Univ, Dept Chem, W Lafayette, IN 47907 USA
基金
美国国家科学基金会;
关键词
polarized; self-modeling curve resolution (smcr); temperature; water; DEPOLARIZATION RATIO; MOLECULAR-DYNAMICS; VIBRATIONAL-SPECTRUM; CURVE RESOLUTION; FERMI RESONANCE; SHELL STRUCTURE; BUTYL ALCOHOL; LOW-FREQUENCY; WATER; SPECTROSCOPY;
D O I
10.1002/jrs.5465
中图分类号
O433 [光谱学];
学科分类号
0703 ; 070302 ;
摘要
Polarized Raman spectra of liquid H2O and D2O have been measured over the entire 100 to 4,000 cm(-1) vibrational frequency range and 280 to 360 K temperature range. The measured spectra are corrected for wavelength-dependent detector quantum efficiency and are provided in numerical form to facilitate comparisons with theoretical predictions. Self-modeling curve resolution is used to decompose the measured spectra into a linear combination of two spectral components whose relative intensities change with temperature but whose shapes are approximately temperature independent. The component whose intensity increases with decreasing temperature contains prominent features in both the high-frequency OH stretch band region and low-frequency OHMIDLINE HORIZONTAL ELLIPSISO hydrogen bond stretch band region that resemble those observed in single crystal ice I-h and clathrate hydrates.
引用
收藏
页码:1860 / 1866
页数:7
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