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Modeling Triatomic Biosignatures: Ozone and Isotopomers (2025)
Journal Article
Cross, T. M., Benoit, D. M., & Pignatari, M. (2025). Modeling Triatomic Biosignatures: Ozone and Isotopomers. The Astrophysical journal, 985(1), Article 110. https://doi.org/10.3847/1538-4357/adbc61

In this work, we present a new approach to produce spectroscopic constants and model first-principles synthetic spectra for all molecules of astrophysical interest. We have generalized our previous diatomic molecule simulation framework, employing tr... Read More about Modeling Triatomic Biosignatures: Ozone and Isotopomers.

A Large-scale Approach to Modeling Molecular Biosignatures: The Diatomics (2022)
Journal Article
Cross, T. M., Benoit, D. M., Pignatari, M., & Gibson, B. K. (2022). A Large-scale Approach to Modeling Molecular Biosignatures: The Diatomics. The Astrophysical journal, 925(1), Article 57. https://doi.org/10.3847/1538-4357/ac3976

This work presents the first steps to modeling synthetic rovibrational spectra for all molecules of astrophysical interest using a new approach implemented in the Prometheus code. The goal is to create a new comprehensive source of first-principles m... Read More about A Large-scale Approach to Modeling Molecular Biosignatures: The Diatomics.