Solver, a flexible and convenient add-in provided with Excel, is useful for fitting of a nonlinear model to experimental data. Solver is introduced to physical chemistry students in the context of the analysis of the fundamental band of the infrared spectrum of gaseous HCl. All peak positions in the P and R branches are used to find least-squares values for the pure vibrational transition, the rotational constants in v = 0 and v = 1 states, and the centrifugal distortion constant.
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Citation
Iannone, Mark. J. Chem. Educ.1998 75 1188.
Keywords
laboratory instruction, physical chem, IR spectroscopy, laboratory computing, interfacing
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