Pressure effects for deuterated organic acids

ACS Symposium Series American Chemical Society Washington, DC, 1975. 

Agreement in the ordering trans-cls-gem Is cited as particularly strong evidence In favor of the correctness of the approach. Note that the order Is symmetry, not model, dependent. The magnitude of the shift does depend on the parameters Inserted into the calculations. In the refined calculation (44) the authors Indicate that anharmonlclty In the rotational potential of the liquid must be taken Into account to fit the data accurately. Later (45) the same force field was used to correlate the molecular volume Iso- 

Recent Work In Our Laboratory Aqueous Solvent Effects 

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