Differences

This shows you the differences between two versions of the page.

--- tools:ase [2019/03/06 07:32] – tmueller
+++ tools:ase [2021/01/19 11:49] (current) – oschuett
@@ Line 1: / Line 1: @@
 ====== Atomic Simulation Environment ======
-The Atomistic Simulation Environment (ASE) is a set of tools and Python modules for setting up, manipulating, running, visualizing and analyzing atomistic simulations. The code is freely available under the GNU LGPL license.
+The Atomistic Simulation Environment (ASE) is a set of tools and Python modules for setting up, manipulating, running, visualizing, and analyzing atomistic simulations. The code is freely available under the GNU LGPL license.
 The ASE comes with a plugin, a so-called calculator, for running simulations with CP2K. The source code of the calculator is in the file [[https://gitlab.com/ase/ase/blob/master/ase/calculators/cp2k.py | ase/calculators/cp2k.py]]. It's documentation can be found [[https://wiki.fysik.dtu.dk/ase/ase/calculators/cp2k.html | here ]].
@@ Line 20: / Line 20: @@
 </code>
-For more examples have a look at the test suite in [[ https://gitlab.com/ase/ase/tree/master/ase/test/cp2k | ase/test/cp2k]].
+For more examples have a look at the test suite in [[ https://gitlab.com/ase/ase/tree/master/ase/test/calculator/cp2k | ase/test/calculator/cp2k]].
 <note warning>