Differences

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--- tools [2015/02/26 13:05] – oschuett
+++ tools [2023/11/10 11:42] (current) – Remove dead link krack
@@ Line 2: / Line 2: @@
 ====== Tools for simplifying your life with CP2K  ======
+===== 3rd party software that interacts with CP2K =====
 <nspages tools -h1 -simpleList -textPages="" >
+===== Basis sets and potentials =====
+  * [[https://htmlpreview.github.io/?https://github.com/cp2k/cp2k-data/blob/master/potentials/Goedecker/index.html|Goedecker-Teter-Hutter (GTH) pseudopotential parameter sets]]
+===== Various script repositories from cp2k users and developers =====
+  * [[https://github.com/dev-zero/cp2k-tools|Simple python scripts by Tiziano Müller]] to mangle/generate cp2k input/output
+  * [[https://github.com/pmamonov/pymol-cp2k-qmmm|&QMMM section generator for PyMOL by Peter Mamonov]]
+  * [[https://github.com/glb96/cp2kRTPtools| Python package by Guillaume Le Breton]] to read time-dependent CP2K output and provide some analysis tool for Real Time analysis