Brain HPC Orca Optimize Submit

brain_hpc_orca_optimize_submit
requires license Calculations brain orca
Submit async geometry optimization with ORCA.

This tool wraps the orca package, which requires a valid third-party license. Availability depends on your Paramus deployment and license entitlements.

Examples

Example brain_hpc_orca_optimize_submit

Submit async geometry optimization with ORCA.

Prompt: “Run submit using orca”

Usage notes

  • BRAIN Platform API: hpc.orca.optimize.submit
  • Requires active BRAIN connection
calculationsorcasubmit