Brain HPC Pyscf Info

brain_hpc_pyscf_info
preview Electronic Structure brain pyscf
Get PySCF module information including version, capabilities, and available methods.

Preview. This tool is available but has not yet completed Paramus output verification. Treat results as provisional.

Examples

Get PySCF info

Prompt: “What PySCF capabilities are available?”

DMRGPython QCinfoperiodic DFTpyscfquantum chemistry