Molecule Types Linear Molecules

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Linear Molecule Sample Data Files

• an O2 microwave spectrum - this is a microwave spectrum and involves a spin magnetic dipole transition moment. If also shows how to simulate for different isotopes, including ¹⁸O¹⁶O (no g/u symmetry) and ¹⁷O¹⁶O (nuclear hyperfine structure)
• The C2 Swan band - this is an example of an electronic spectrum. Two examples are given; one is a simple example including one vibrational band only, the other is more complicated and includes many vibrational bands.
• Hyperfine structure in the B - X transition in I₂. This shows how to handle hyperfine structure and take account of equivalent nuclei.
• Zeeman and Stark Effects in SO - this shows the sort of set up required to simulate the defects of external fields, and to fit line position data in the presence of a field.