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python3-pyscf-2.4.0-3.fc40 RPM for s390x

From Fedora 40 for s390x / p

Name: python3-pyscf Distribution: Fedora Project
Version: 2.4.0 Vendor: Fedora Project
Release: 3.fc40 Build date: Fri Jan 26 10:22:12 2024
Group: Unspecified Build host: buildvm-s390x-22.s390.fedoraproject.org
Size: 79760991 Source RPM: python-pyscf-2.4.0-3.fc40.src.rpm
Packager: Fedora Project
Url: https://github.com/pyscf/pyscf/
Summary: Python 3 module for quantum chemistry
 
Python‐based simulations of chemistry framework (PySCF) is a
general‐purpose electronic structure platform designed from the ground
up to emphasize code simplicity, so as to facilitate new method
development and enable flexible computational workflows. The package
provides a wide range of tools to support simulations of finite‐size
systems, extended systems with periodic boundary conditions,
low‐dimensional periodic systems, and custom Hamiltonians, using
mean‐field and post‐mean‐field methods with standard Gaussian basis
functions. To ensure ease of extensibility, PySCF uses the Python
language to implement almost all of its features, while
computationally critical paths are implemented with heavily optimized
C routines. Using this combined Python/C implementation, the package
is as efficient as the best existing C or Fortran‐based quantum
chemistry programs.

Provides

Requires

License

ASL 2.0

Changelog

* Fri Jan 26 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2.4.0-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild
* Mon Jan 22 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2.4.0-2
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild
* Fri Oct 20 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.4.0-1
  - Update to 2.4.0.
* Fri Jul 21 2023 Fedora Release Engineering <releng@fedoraproject.org> - 2.3.0-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild
* Wed Jul 12 2023 Python Maint <python-maint@redhat.com> - 2.3.0-2
  - Rebuilt for Python 3.12
* Sat Jul 08 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.3.0-1
  - Update to 2.3.0.
* Mon Apr 03 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.2.1-1
  - Update to 2.2.1.
* Thu Mar 16 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.2.0-1
  - Update to 2.2.0.
* Fri Jan 20 2023 Fedora Release Engineering <releng@fedoraproject.org> - 2.1.1-3
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild
* Tue Oct 25 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.1.1-2
  - Rebuild with libxc 6.0.0 in rawhide.
* Mon Sep 26 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.1.1-1
  - Update to 2.1.1.
* Sun Sep 04 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 2.1.0-1
  - Update to 2.1.0.
* Fri Jul 22 2022 Fedora Release Engineering <releng@fedoraproject.org> - 2.0.1-6
  - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild
* Tue Jun 14 2022 Python Maint <python-maint@redhat.com> - 2.0.1-5
  - Rebuilt for Python 3.11

Files

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Fabrice Bellet, Wed Jul 10 00:08:09 2024