nwchem
Install command:
brew install nwchemHigh-performance computational chemistry tools
License: ECL-2.0
Formula JSON API: /api/formula/nwchem.json
Formula code: nwchem.rb on GitHub
Bottle (binary package) installation support provided for:
| Intel | ventura | ✅ |
|---|---|---|
| monterey | ✅ | |
| big sur | ✅ | |
| 64-bit linux | ✅ | |
| Apple Silicon | ventura | ✅ |
| monterey | ✅ | |
| big sur | ✅ | |
Current versions:
| stable | ✅ | 7.2.0 |
Depends on:
| gcc | 12.2.0 | GNU compiler collection |
| libxc | 6.1.0 | Library of exchange and correlation functionals for codes |
| open-mpi | 4.1.5 | High performance message passing library |
| openblas | 0.3.21 | Optimized BLAS library |
| python@3.11 | 3.11.2 | Interpreted, interactive, object-oriented programming language |
| scalapack | 2.2.0 | High-performance linear algebra for distributed memory machines |
Analytics (macOS):
| Installs (30 days) | |
|---|---|
nwchem |
1 |
| Installs on Request (30 days) | |
nwchem |
1 |
| Build Errors (30 days) | |
nwchem |
0 |
| Installs (90 days) | |
nwchem |
51 |
| Installs on Request (90 days) | |
nwchem |
51 |
| Installs (365 days) | |
nwchem |
359 |
| Installs on Request (365 days) | |
nwchem |
359 |
Analytics (Linux):
| Installs (30 days) | |
|---|---|
nwchem |
0 |
| Installs on Request (30 days) | |
nwchem |
0 |
| Build Errors (30 days) | |
nwchem |
0 |
| Installs (90 days) | |
nwchem |
0 |
| Installs on Request (90 days) | |
nwchem |
0 |
| Installs (365 days) | |
nwchem |
5 |
| Installs on Request (365 days) | |
nwchem |
5 |
