diff --git a/anselm.csv b/anselm.csv index b2389a043c82f7884ca5eeb531c0ed5d56f69f33..60cd35610cd788a9d7b10f2df6ecd701be1fa605 100644 --- a/anselm.csv +++ b/anselm.csv @@ -482,6 +482,7 @@ Keras/2.0.5-Theano-1.2.0-Python-3.6.1,1 Keras/2.0.8-Tensorflow-1.1.0-CUDA-8.0.44-Python-3.6.1,1 Keras/2.1.2-Tensorflow-1.1.0-CUDA-8.0.44-Python-3.6.1,1 lam/7.1.4-icc,1 +LAMMPS/17Jan2018-intel-2017a-CUDA,1 lammps/28Jun14,1 LevelDB/1.18,1 libcerf/1.5,1 diff --git a/anselm.md b/anselm.md index 33114e7cba39ad5ee5d62ff6197c625c43a20663..79d4304bd0a320b9781a55f88f2d7e91b376975a 100644 --- a/anselm.md +++ b/anselm.md @@ -34,6 +34,7 @@ | [ASE](https://wiki.fysik.dtu.dk/ase/) | ASE is a python package providing an open source Atomic Simulation Environment in the Python scripting language. | | cp2k-mpi | | | lammps | | +| [LAMMPS](http://lammps.sandia.gov) | LAMMPS is a classical molecular dynamics code, and an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. Has potentials for solid-state materials (metals, semiconductors) and soft matter (biomolecules, polymers) and coarse-grained or mesoscopic systems. It can be used to model atoms or, more generically, as a parallel particle simulator at the atomic, meso, or continuum scale. | | libxc | | | molpro | | | namd | |