libcint
- Robert Schade
- Axel Keller
Description
libcint is an open source library for analytical Gaussian integrals. It provides C/Fortran API to evaluate one-electron / two-electron integrals for Cartesian / real-spheric / spinor Gaussian type functions.
More information
- Homepage: https://github.com/sunqm/libcint
Available Versions of libcint
Version | Module | Available on |
|---|---|---|
5.5.0-gfbf-2023b-PYPZPX | chem/libcint/5.5.0-gfbf-2023b-PYPZPX | Noctua 2 |
5.5.0-gfbf-2023b | chem/libcint/5.5.0-gfbf-2023b | Noctua 2 |
5.4.0-gfbf-2023a | chem/libcint/5.4.0-gfbf-2023a | Noctua 2 |
4.1.1-intel-2021b | chem/libcint/4.1.1-intel-2021b | Noctua 1 |
This table is generated automatically. If you need other versions please click pc2-support@uni-paderborn.de.
Usage Hints for libcint
If you need support in using this software or example job scripts please contact pc2-support@uni-paderborn.de.