2500 vibronic eigenstates of the NO3 radical

Henrik R Larsson1, Alexandra Viel2

  • 1Department of Chemistry and Biochemistry, University of California, Merced, CA 95343, USA. NO3a[at]larsson-research.δe.

Summary

Researchers studied the vibronic structure of the nitrate radical (NO3) using advanced computational methods. They computed over 2500 states, revealing significant discrepancies with experimental data and highlighting the limitations of the Born-Oppenheimer approximation.

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