Hellmann-Feynman · Forces from a Fixed Wavefunction
unseel.com · frozen electron cloud · pure Coulomb force · dE/dλ = ⟨ψ|∂H/∂λ|ψ⟩
Net force 0 eV/Å
Bond R 0.74 Å
state
Nuclei (protons, +Z)
Electron density n(r)
Coulomb force on nucleus
Energy curve E(R)
Unseel.com · The Hellmann-Feynman Theorem