Type-erasure for floating point types. Facilitates writing general floating-point code without needing to worry about the exact floating-point type being used.

NWChemEx Spack Package Repositories

Basis sets, physical constants, geometries, basically any data you can just look up.

NWChemEx User Experience (NUX): Tools, functions, etc. to facilitate user workflows

GitHub Settings for the NWChemEx Organization

Tensor Algebra for many-body methods

A top-level, user-focused, conglomerate repo for the NWChemEx project.

A type-erased wrapper around various tensor backends