Abstract

A calculator program TRPR3 is described for evaluation of the Teller-Redlich product rule for isotopically substitued non-linear X—Y—Z molecules with given bond lengths and valence angle. The program is used to examine the tentative vibrational band assignments and also to study the geometrical molecular parameters by comparison of the theoretical and experimental product ratios. Coding is given for the Texas Instruments TI-59 programmable calculator.

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