Brain HPC Ase Version

brain_hpc_ase_version
verified Molecular Modeling brain ase
Get ASE version information from BRAIN HPC platform.

Parameters

NameTypeRequiredDescription
input_data string yes Input data for calculation

Examples

Example ASE hpc ase version

Checking Atomic Simulation Environment version for compatibility with calculation methods

Prompt: “What version of ASE is installed?”

brain_hpc_ase_version(input_data=...)

Usage notes

  • ASE HPC module
  • Layer 3 Docker container architecture
  • GPU acceleration available where supported
ExamplePython atomsaseatomistic simulationsurface scienceversion