Tools

• Hardware
  • For development and testing 3 Dual 3Ghz Workstations
  • Calculations are run on the Pleiades Cluster at EPFL
  • The mxsg2 SGI Altix machine at EPFL
  • Large molecular dynamics simulations on the Mizar Cluster at EPFL
  • And for large sampling jobs the combined calculation power of EPFLs computers through the greedy grid
• Software
  • MS Modelling
  • METADISE
  • DL_POLY
  • GULP
  • gdis
  • CPMD
  • Abinit
  • VMD
  • LAMMPS
  • R
  • Lots of in-house tools for simulation setup and analysis