Abstract
The previously proposed simple analytical polynomial (non-exponential) wave function in elliptical coordinates has been applied for heteronuclear two-center systems. The calculated ground state energy values determined in third-tenth order approximation agree very well with the exact values for the HeH2+, LiH3+ and the HeLi4+, in the whole interval of the internuclear distance.
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Tamássy-Lentei, I., Szabó, J. Polynomial (non-exponential) wave functions in calculations for heteronuclear molecular systems. Acta Physica 36, 323–329 (1974). https://doi.org/10.1007/BF03157918
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DOI: https://doi.org/10.1007/BF03157918