CPPE

CPPE is an open-source, light-weight C++ and Python library for Polarizable Embedding (PE)1,2 calculations. It provides an easy-to-use API to implement PE for ground-state self-consistent field (SCF) calculations and post-SCF methods. A convenient Python interface is also available.

homepage: https://github.com/maxscheurer/cppe

version	toolchain
0.3.1	GCC/11.3.0
0.3.1	GCC/12.2.0

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