Abstract
An open-shell configuration interaction (CI) calculation was carried out for the \( {}^2\sum\nolimits_u^{+} {} \) and the \( {}^2\sum\nolimits_g^{+} {} \) states of the H −2 system, and a number of adiabatic potential energy curves was obtained for internuclear separations between 1.05 and 4.00 au. The goal of this work was to search for possible H −2 resonances within about a 10 eV energy region above the ground target state.
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© 1984 Springer-Verlag Berlin Heidelberg
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Nazaroff, G.V. (1984). A Theoretical Study of the H −2 System at Low Energies. In: Gianturco, F.A., Stefani, G. (eds) Wavefunctions and Mechanisms from Electron Scattering Processes. Lecture Notes in Chemistry, vol 35. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-46502-4_17
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DOI: https://doi.org/10.1007/978-3-642-46502-4_17
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