Configuration Interaction · Mixing Electronic Excitations to Recover Electron Correlation
unseel.com · H₂ · σ_g / σ_u* · Full CI
state HF reference
c₀ 1.00
c₂ 0.00
step
σ_g bonding (Φ₀)
σ_u* antibonding (Φ₂)
electrons
ionic character
Unseel.com · Configuration Interaction Unseel.com · Configuration Interaction — Concepts