From 54b513e6b0eebd023a7a3202f9d8c194d718908a Mon Sep 17 00:00:00 2001 From: "T. van der Sar" <t.vandersar@tudelft.nl> Date: Fri, 25 Feb 2022 12:18:54 +0000 Subject: [PATCH] Update 5_atoms_and_lcao.md - typo fix --- docs/5_atoms_and_lcao.md | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/docs/5_atoms_and_lcao.md b/docs/5_atoms_and_lcao.md index d4d134fd..97f0072f 100644 --- a/docs/5_atoms_and_lcao.md +++ b/docs/5_atoms_and_lcao.md @@ -396,7 +396,7 @@ What are the new onsite energies of the two orbitals? #### Question 3. Diagonalize the modified LCAO Hamiltonian. Find the ground state wavefunction $ψ$. Note: for simplicity assume that the electric field is small, such that $\gamma \ll t$, with $\gamma = e d \mathcal{E}/2$. #### Question 4. -Find the polarization $P$ of the molecule in the ground state. Check if your answer makes sense for $\matthcal{E}=0$. +Find the polarization $P$ of the molecule in the ground state. Check if your answer makes sense when you set the electric field to zero. ??? hint "Reminder: polarization" The polarization $P$ of a molecule with $n\leq 2$ electrons at its ground state $|ψ⟩$ is: -- GitLab