Quick-QM-Spectra: Spectra from Electronic Structure Program Output

This program is intended to take an output file from an electronic structure calculation and create a spectrum for comparison with experimental data.

If this website is used to generate images for a publication or presentation, the authors would greatly appreciate the inclusion of this citation:
Leverentz-Culp, H. R.; West, J. K. Quick-QM-Spectra (QQMS): A Website for the Visualization of Spectra and Molecules from the Output of Free Open-Source Electronic Structure Programs J. Chem. Educ. 2025 102(4), 1709-1716. DOI: 10.1021/acs.jchemed.4c01547


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Simply click on the blue button below to select your output file.

Note: if, after viewing a spectrum below, you want to generate a new spectrum with different settings, you will need to click your browser's "refresh" button.


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Extensions: .txt, .text, .out, .dat, or .gam
<60MB