Paramus Catalog

Brain HPC Gamess Kernel Execute

brain_hpc_gamess_kernel_execute
requires license Electronic Structure brain gamess

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Execute command in GAMESS shell session

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

Parameters

NameTypeRequiredDescription
input_data string yes Input data for calculation

Examples

Example GAMESS hpc gamess kernel execute

Running interactive quantum chemistry commands in GAMESS shell

Prompt: “Execute a GAMESS command in the active session”

brain_hpc_gamess_kernel_execute(input_data=...)

Usage notes

  • GAMESS HPC module
  • Layer 3 Docker container architecture
  • GPU acceleration available where supported
ExampleHartree-FockMCSCFab initioexecutegamesskernelquantum chemistry