ListarInvestigación y Desarrollo por tema "fluxionality"

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    • Article

      B3Al4+: A Three-Dimensional Molecular Reuleaux Triangle (2024) 

      Bai, Li-Xia; Orozco-Ic, Mesías; Zarate, Ximena; Sundholm, Dage; Pan, Sudip; Guo, Jin-Chang; Merino, Gabriel (MDPI, 2022)
      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 ...