LCPQ/quack
4
1
Fork 0
mirror of https://github.com/pfloos/quack synced 2024-11-19 04:22:39 +01:00
Code Releases Activity

Update README.md

Browse Source
This commit is contained in:
Pierre-Francois Loos 2023-07-10 20:16:59 +02:00 committed by GitHub
parent 2dca322b70
commit ac25c5fa70
No known key found for this signature in database
GPG Key ID: 4AEE18F83AFDEB23
1 changed files with 1 additions and 1 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

2
README.md
View File

@ -9,7 +9,7 @@
# What is it?
QuAcK is a small electronic structure program written in `Fortran 90` and developed at the Laboratoire de Chimie et Physique Quantiques [LCPQ](https://www.lcpq.ups-tlse.fr) (Toulouse, France).
QuAcK is usually used for prototyping purposes and the successful ideas are usually implemented more efficiently in [quantum package](https://quantumpackage.github.io/qp2/). QuAcK is an excellent place to start for experienced PhD students or postdocs as the code is simple and written in a fairly well-known and straightforward language.
QuAcK is usually used for prototyping purposes and the successful ideas are usually implemented more efficiently in [quantum package](https://quantumpackage.github.io/qp2/). QuAcK is an excellent place to start for experienced PhD students or postdocs as the code is simple and written in a fairly well-known and straightforward language. For beginners, we suggest having a look at [qcmath](https://github.com/LCPQ/qcmath/), a Mathematica-based program to help newcomers in quantum chemistry easily develop their ideas.
# Installation guide
The QuAcK software can be downloaded on GitHub as a Git repository