4.7 Article

ExoMol line lists - IV. The rotation-vibration spectrum of methane up to 1500 K

期刊

出版社

OXFORD UNIV PRESS
DOI: 10.1093/mnras/stu326

关键词

molecular data; opacity; astronomical data bases: miscellaneous; planets and satellites: atmospheres; stars: low-mass

资金

  1. STFC
  2. ERC [267219]
  3. BIS
  4. Science and Technology Facilities Council [ST/K00333X/1, ST/J005673/1, ST/H008586/1, ST/J001511/1] Funding Source: researchfish
  5. STFC [ST/J005673/1, ST/H008586/1, ST/J001511/1, ST/K00333X/1] Funding Source: UKRI

向作者/读者索取更多资源

A new hot line list is calculated for (CH4)-C-12 in its ground electronic state. This line list, called 10to10, contains 9.8 billion transitions and should be complete for temperatures up to 1500 K. It covers the wavelengths longer than 1 mu m and includes all transitions to upper states with energies below hc center dot 18 000 cm(-1) and rotational excitation up to J = 39. The line list is computed using the eigenvalues and eigenfunctions of CH4 obtained by variational solution of the Schrodinger equation for the rotation-vibration motion of nuclei employing program trove and a new 'spectroscopic' potential energy surface (PES) obtained by refining an ab initio PES (CCSD(T)-F12c/aug-cc-pVQZ) through least-squares fitting to the experimentally derived energies with J = 0-4 and a previously reported ab initio dipole moment surface (CCSD(T)-F12c/aug-cc-pVTZ). Detailed comparisons with other available sources of methane transitions including HITRAN, experimental compilations and other theoretical line lists show that these sources lack transitions both higher temperatures and near-infrared wavelengths. The 10to10 line list is suitable for modelling atmospheres of cool stars and exoplanets. It is available from the CDS data base as well as at www.exomol.com.

作者

我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。

评论

主要评分

4.7
评分不足

次要评分

新颖性
-
重要性
-
科学严谨性
-
评价这篇论文

推荐

暂无数据
暂无数据