With an 18-term wavefunction, using 16 generalized Gaussian orbitals as a basis, we find a minimum energy of −1.3185 a.u. for H3+ in an equilateral triangular configuration having sides 1.66 bohr The A1′ normal mode of vibration has ω0=3610 cm−1. Several energy contours are presented and their relation to H2+D+→HD+H+ reactions is sketched.
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Pearson et al. (1966) studied this question.
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