A High-Temperature Partition Function for H 3 +

Astronomy and Astrophysics – Astronomy

Scientific paper

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Molecular Data, Stars: Atmospheres

Scientific paper

{H}^{+}3 is the main supplier of electrons to metal-free stars below ~8000 K. To describe {H}^{+}3 properly it is important to know its partition function. Previous determinations of this function are based on extrapolations from lower temperatures. A new partition function is presented that is calculated by explicit ab initio computation of levels lying up to 15,000 cm-1 above the ground state and with J <= 20. The effect of all other bound levels of {H}^{+}3 , which is significant at higher temperatures, is included using a simple model based on Pade approximants. The new partition function is very significantly larger (up to a factor of 100 in some cases) than previous estimates above 3000 K.

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