Global minimizer conjecture for the Morse potential lattice energy
Global minimizer conjecture for the Morse potential lattice energy
Let . For a Bravais lattice in dimension , let denote the Morse lattice energy, let be the class of Bravais lattices, and let be the class of periodic structures. Let BCC, FCC, and HCP denote body-centered cubic, face-centered cubic, and hexagonal close-packed structures, respectively. Global minimizer conjecture. There exist parameters and such that:
- If , then the global minimizer of in is a BCC lattice.
- If , then the global minimizer of in is an FCC lattice, whereas the global minimizer in is an HCP structure.
- If , then the unique minimizer of in is an FCC lattice.
The conjecture predicts transitions among BCC, FCC, and HCP minimizers as the Morse parameter varies. The proposed transition is motivated by numerical computations and is heuristically justified in the paper for the BCC/FCC transition using a conjecture on lattice theta functions; the asserted global minimization statements remain open.
Sources & referencesView supporting material
Primary source
Laurent Bétermin, “Minimizing lattice structures for Morse potential energy in two and three dimensions”, arXiv:1901.08957 (2019).
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