User Guide# Get Started Installation Clone and Install from Source Verify the Installation Check GPU Support (Optional) How to run PYSEQM Run PYSEQM Introduction Workflow Overview Minimal Input File Template Components and Features Initialization Single-Point SCF Calculations CIS & RPA Excited State Calculations Born–Oppenheimer Molecular Dynamics (BOMD) Extended Lagrangian Born Oppenheimer Molecular Dynamics (XL-BOMD) Geometry Optimization