Brain HPC Psi4 Kernel Stop

brain_hpc_psi4_kernel_stop
verified Electronic Structure brain psi4
Stop PSI4 REPL session (v1.7).

Parameters

NameTypeRequiredDescription
input_data string yes Input data for calculation

Examples

Stop Psi4 Session

Terminating an interactive Psi4 REPL session

Prompt: “Stop the active Psi4 kernel session”

brain_hpc_psi4_kernel_stop(input_data='session_id_123')

Usage notes

  • Psi4 HPC module
  • Layer 3 Docker container architecture
  • GPU acceleration available where supported
DFTPsi4SCFSessionStopab initiokernelquantum chemistrywavefunction