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viv-lang.org

vp.xc.functionalsComing soon

The exchange-correlation functionals of Libxc's LDA and GGA families, evaluated on a density grid: energy density and potential.

Part of the distribution vipyr-xc. Planned on PyPI as pip install "vipyr[xc]".

Status

Coming soon. It is listed but not built yet: calling it raises NotImplementedError.

xc/ holds them as Viv, generated from Libxc's Maple sources by tools/vivxc and checked by xc/tests/oracle.py; they have no manifest yet.