Repositorio de Universidad Autónoma de Chile.
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B3Al4+: A Three-Dimensional Molecular Reuleaux Triangle
We systematically explore the potential energy surface of the B3Al4+ combination of atoms. The putative global minimum corresponds to a structure formed by an Al4 square facing a B3 triangle. Interestingly, the dynamical behavior can be described as a Reuleaux molecular triangle since it involves th
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