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Hydrogen molecule-antihydrogen atom potential energy surface and scattering calculations
2019
Journal of Physics B: Atomic, Molecular and Optical Physics
We have calculated ground state interaction energies for an antihydrogen atom and a hydrogen molecule within the Born-Oppenheimer approximation. Leptonic energies were calculated using a large basis set of explicitly correlated Gaussian functions. Energies were calculated at over 2800 geometries including different proton-proton distances. The energies have been fit to functional forms using a neural network for the short-range interaction which is combined with asymptotic formulas at long
doi:10.1088/1361-6455/ab312e
fatcat:mt2fgigfvfcipopinxsmb4duyy