psi4
An ab initio quantum chemistry package
PSI4 is an open-source suite of ab initio quantum chemistry programs designed for efficient, high-accuracy simulations of a variety of molecular properties. We can routinely perform computations with more than 2500 basis functions running serially or in parallel.
Releases Overview
| Release | Stable | Testing |
|---|---|---|
| Fedora Rawhide | 1.9.1-6.fc42 | - |
| Fedora 43 | 1.9.1-6.fc42 | - |
| Fedora 42 | 1.9.1-6.fc42 | - |
| Fedora 41 | 1.9.1-3.fc41 | 1.9.1-1.fc41 |
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Package Info
Related Packages
Package Info
- Upstream: http://www.psicode.org/
- License(s): LGPL-3.0-only AND LicenseRef-Callaway-MIT
- Maintainer: jussilehtola
Related Packages
You can contact the maintainers of this package via email at
psi4 dash maintainers at fedoraproject dot org.
Sources on Pagure