JuliaAtoms / EnergyExpressions.jl

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Multi-configurational equation derivation type unstable #2

Open jagot opened 5 years ago

jagot commented 5 years ago

As it is, the multi-configurational equation derivation in multi_configurational_equations.jl works, but it is a massive hack and type unstable, i.e. nothing is specialized on the kind of orbitals used, etc. This must probably be fixed for performance when dealing with large numbers of configurations.