| search | ||
|---|---|---|
|
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 |
../0/index.md - ../a/index.md - ../b/index.md - ../c/index.md - ../d/index.md - ../e/index.md - ../f/index.md - ../g/index.md - ../h/index.md - ../i/index.md - ../j/index.md - ../k/index.md - ../l/index.md - ../m/index.md - ../n/index.md - ../o/index.md - ../p/index.md - ../q/index.md - ../r/index.md - ../s/index.md - ../t/index.md - ../u/index.md - ../v/index.md - ../w/index.md - ../x/index.md - ../y/index.md - ../z/index.md