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. 2016 Dec 27;114(2):322–327. doi: 10.1073/pnas.1612480114

Table 1.

Spectral parameters of the νOD of liquid solvent, solutions of gases, NaCl solution, clathrates, and ice

Sample T p νOD ΔνOD Hw
Pure solvent* 293 1 2,502 (±1) 0 164 (±2)
Pure solvent* 293 56 2,502 (±1) 0 (±2) 160 (±2)
Pure solvent* 285 1 2,498 (±1) 4 (±2) 158 (±2)
Pure solvent* 285 56 2,498 (±1) 4 (±2) 158 (±2)
CH4 solution 285 56 2,445 (±5) 57 (±8) 92 (±8)
C2H5 solution 291 14 2,430 (±5) 78 (±8) 86 (±8)
Xe solution 299 16 2,442 (±5) 60 (±8) 96 (±8)
Kr solution 289 50 2,445 (±5) 57 (±8) 87 (±8)
NaCl solution 285 53 2,536 (±5) −34 (±8) 166 (±8)
CH4 clathrate§ 275 40 2,446 (±1) 56 (±2) 60 (±2)
C2H5 clathrate§ 276 7 2,442 (±1) 60 (±2) 80 (±2)
Xe clathrate§ 292 18 2,442 (±1) 60 (±2) 79 (±2)
Kr clathrate§ 274 56 2,446 (±1) 56 (±2) 55 (±2)
Ice Ih 271 1 2,445 (±1) 57 (±2) 37 (±2)

Temperature T (Kelvin), pressure p (bar), frequency at maximum intensity νOD (centimeters−1), frequency redshift ΔνOD (centimeters−1), and half-width Hw (centimeters−1) are shown. Hw is defined as the width of a peak at one-half height. Errors in measuring T and p are estimated at 0.5 K and 0.5 bars, respectively. All samples contain a solvent mixture of 2.8% HDO in H2O.

*

Solvent mixture (2.8% HDO in H2O) under four different conditions.

Spectral parameters of the water molecules perturbed by solutes (Fig. 1B).

Solution of 0.03 M NaCl used for verification of the subtraction procedure (SI Appendix, Figs. S4 and S6). Note that the Hw of its νOD is equal to that of liquid solvent.

§

Solid state (SI Appendix, Fig. S3).

Shoulder at 2,472 (±1) cm−1.