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AMP

Description

amp website

Amp is python-based and is designed to integrate closely with the Atomic Simulation Environment (ASE). Because of this tight integration, Amp is compatible with every major electronic structure calculator and has ready access to all standard atomistic methods, such as structure optimization or molecular dynamics. In its most basic form, it has few requirements:

Environment Modules

Run module spider amp to find out what environment modules are available for this application.

Environment Variables

  • HPC_AMP_DIR - installation directory
  • HPC_AMP_BIN - executable directory

Categories

phylogenetics