cp2k

Install command: 
brew install cp2k

Quantum chemistry and solid state physics software package

https://www.cp2k.org/

License: GPL-2.0-or-later

Formula JSON API: /api/formula/cp2k.json

Formula code: cp2k.rb on GitHub

Bottle (binary package) installation support provided for:

macOS on
Apple Silicon		 tahoe ✅
sequoia ✅
sonoma ✅
ventura ✅
macOS on
Intel		 sonoma ✅
ventura ✅
Linux ARM64 ✅
x86_64 ✅

Current versions:

stable ✅ 2025.1

Depends on:

fftw 3.3.10 C routines to compute the Discrete Fourier Transform
gcc 15.2.0 GNU compiler collection
libxc 7.0.0 Library of exchange and correlation functionals for codes
open-mpi 5.0.8 High performance message passing library
openblas 0.3.30 Optimized BLAS library
scalapack 2.2.2 High-performance linear algebra for distributed memory machines

Depends on when building from source:

cmake 4.1.2 Cross-platform make
fypp 3.2 Python powered Fortran preprocessor
pkgconf 2.5.1 Package compiler and linker metadata toolkit

Analytics:

Installs (30 days)
cp2k 27
Installs on Request (30 days)
cp2k 27
Build Errors (30 days)
cp2k 2
Installs (90 days)
cp2k 224
Installs on Request (90 days)
cp2k 224
Installs (365 days)
cp2k 694
cp2k --HEAD 1
Installs on Request (365 days)
cp2k 694
cp2k --HEAD 1