论文标题
Exomol线列表-XXXVIII。二氧化硅的高温分子线列表（Sio $ _ {\ Mathbf {2}} $）
ExoMol line lists -- XXXVIII. High-temperature molecular line list of silicon dioxide (SiO$_{\mathbf{2}}$)
论文作者
论文摘要
二氧化硅（SIO $ _2 $）预计将发生在热岩石超级地球外行星的大气中，但缺乏光谱数据会妨碍其可能的检测。在这里，我们介绍了SIO $ _2 $的第一个全面的分子线列表。名为Oyt3的行列表覆盖了Wavenumber范围0 \， - \，6000〜cm $^{ - 1} $（波长$λ> 1.67 $〜$μ$ m），适合最多$ $ t = 3000 $ 〜k。使用强大的第一原理方法计算了近330亿个涉及569万旋转振动状态，旋转激发最高$ j = 255 $的过渡。 OYT3行列表可从http://www.exomol.com的Exomol数据库获得。
Silicon dioxide (SiO$_2$) is expected to occur in the atmospheres of hot rocky super-Earth exoplanets but a lack of spectroscopic data is hampering its possible detection. Here, we present the first, comprehensive molecular line list for SiO$_2$. The line list, named OYT3, covers the wavenumber range 0\,--\,6000~cm$^{-1}$ (wavelengths $λ> 1.67$~$μ$m) and is suitable for temperatures up to $T=3000$~K. Almost 33 billion transitions involving 5.69 million rotation-vibration states with rotational excitation up to $J=255$ have been computed using robust first-principles methodologies. The OYT3 line list is available from the ExoMol database at http://www.exomol.com.
