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physics.chem-ph2019★ 31 cited
Molecular Simulations for the Spectroscopic Detection of Atmospheric Gases
Clara Sousa-Silva, Janusz J Petkowski, Sara Seager
Unambiguously identifying molecules in spectra is of fundamental importance for a variety of scientific and industrial uses. Interpreting atmospheric spectra for the remote detecti…
physics.chem-ph2016★ 17 cited
Tunnelling splitting in the phosphine molecule
Clara Sousa-Silva, Jonathan Tennyson, Sergey N. Yurchenko
Splitting due to tunnelling via the potential energy barrier has played a significant role in the study of molecular spectra since the early days of spectroscopy. The observation o…