There is desire for the ability to call certain basis expansions from ACE.jl within the InteratomicPotentials.jl framework. A wrapper needs to be devised and implemented for specific expansions that we want implemented. This interface should take advantage of the BasisPotential types already implemented in InteratomicPotentials.jl.
There is desire for the ability to call certain basis expansions from ACE.jl within the InteratomicPotentials.jl framework. A wrapper needs to be devised and implemented for specific expansions that we want implemented. This interface should take advantage of the BasisPotential types already implemented in InteratomicPotentials.jl.