Quantum chemistry and solid state physics software package
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:
Apple Silicon | sequoia | ✅ |
---|---|---|
sonoma | ✅ | |
ventura | ✅ | |
monterey | ✅ | |
Intel | sonoma | ✅ |
ventura | ✅ | |
monterey | ✅ | |
64-bit linux | ✅ |
Current versions:
stable | ✅ | 2024.3 |
Depends on:
fftw | 3.3.10 | C routines to compute the Discrete Fourier Transform |
gcc | 14.2.0 | GNU compiler collection |
libxc | 6.2.2 | Library of exchange and correlation functionals for codes |
open-mpi | 5.0.6 | High performance message passing library |
openblas | 0.3.28 | Optimized BLAS library |
scalapack | 2.2.0 | High-performance linear algebra for distributed memory machines |
Depends on when building from source:
cmake | 3.31.2 | Cross-platform make |
pkgconf | 2.3.0 | Package compiler and linker metadata toolkit |
Analytics:
Installs (30 days) | |
---|---|
cp2k |
47 |
Installs on Request (30 days) | |
cp2k |
47 |
Build Errors (30 days) | |
cp2k |
2 |
Installs (90 days) | |
cp2k |
165 |
Installs on Request (90 days) | |
cp2k |
165 |
Installs (365 days) | |
cp2k |
845 |
cp2k --HEAD |
1 |
Installs on Request (365 days) | |
cp2k |
845 |
cp2k --HEAD |
1 |