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Determination of fundamental properties of nitrogen from first principles. II. Potential energy curve and spectroscopic properties of N$_2$

Lang, Jakub et al.
arXiv (All) · Papers
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chemical-physics
This work is the second part of the series devoted to first-principles determination of the fundamental properties of nitrogen. In this part, we calculate the potential energy curve for the electronic ground state of N$_2$. The potential is divided into three components: short-, medium-, and long-ra
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