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Nonrelativistic Quantum Mechanics

Nonrelativistic Field Operators

One difference in nonrelativistic quantum mechanics is that the noninteracting solutions to the equation of motion (Schrödinger equation in this case) can be numbered using a discrete index, so for example the momentum q\mathbf{q} is not continuous, thus the (anti)commutation relations for creation and anihilation operators contain the Kronecker delta (instead of a delta function) and integrals over the index are replaced by sums. The reason for that is that we usually employ boundary conditions (like a lattice, or one particle potential due to nuclei, etc.) that make the spectrum discrete.

For bosons the field operators are given by:

ψ^(x)=∑kψk(x)ck\hat\psi({\mathbf{x}}) = \sum_k \psi_k({\mathbf{x}}) c_k
ψ^†(x)=∑kψk∗(x)ck†\hat\psi^\dag({\mathbf{x}}) = \sum_k \psi_k^*({\mathbf{x}}) c_k^\dag

where the coefficients are the single-particle wave functions.

[ck,cl†]=δkl[c_k, c_l^\dag] = \delta_{kl}
[ck,cl]=[ck†,cl†]=0[c_k, c_l] = [c_k^\dag, c_l^\dag] = 0

so the commutation relations for ψ^\hat\psi and ψ^†\hat\psi^\dagger are:

[ψ^(x),ψ^†(y)]=δ(3)(x−y)[ \hat\psi({\mathbf{x}}), \hat\psi^\dag({\mathbf{y}}) ] = \delta^{(3)}({\mathbf{x}}-{\mathbf{y}})
[ψ^(x),ψ^(y)]=[ψ^†(x),ψ^†(y)]=0[ \hat\psi({\mathbf{x}}), \hat\psi({\mathbf{y}}) ] = [ \hat\psi^\dag({\mathbf{x}}), \hat\psi^\dag({\mathbf{y}}) ] = 0

For fermions:

ψ^(x)=∑k∑s=12ψks(x)ck\hat\psi({\mathbf{x}}) = \sum_k\sum_{s=1}^2 \psi_k^s({\mathbf{x}}) c_k
ψ^†(x)=∑k∑s=12ψks∗(x)ck†\hat\psi^\dag({\mathbf{x}}) = \sum_k\sum_{s=1}^2 \psi_k^{s*}({\mathbf{x}}) c_k^\dag

where

{ck,cl†}=δkl\{c_k, c_l^\dag\} = \delta_{kl}
{ck,cl}={ck†,cl†}=0\{c_k, c_l\} = \{c_k^\dag, c_l^\dag\} = 0

so the commutation relations for ψ^\hat\psi and ψ^†\hat\psi^\dagger are:

{ψ^(x),ψ^†(y)}=δ(3)(x−y)\{\hat\psi({\mathbf{x}}), \hat\psi^\dag({\mathbf{y}})\} =\delta^{(3)}({\mathbf{x}}-{\mathbf{y}})
{ψ^(x),ψ^(y)}={ψ^†(x),ψ^†(y)}=0\{\hat\psi({\mathbf{x}}), \hat\psi({\mathbf{y}})\} = \{\hat\psi^\dag({\mathbf{x}}), \hat\psi^\dag({\mathbf{y}})\} = 0

The (interacting) Hamiltonian for both bosons and fermions is

iℏ∂t∣Ψ(t)⟩=H^∣Ψ(t)⟩i\hbar\partial_t|\Psi(t)\rangle = \hat H|\Psi(t)\rangle
H^=T^+V^=∑ijci†⟨i∣T∣j⟩cj+12∑ijklci†cj†⟨ij∣V∣kl⟩clck\hat H = \hat T + \hat V = \sum_{ij} c_i^\dag\langle i|T|j \rangle c_j + \frac{1}{2} \sum_{ijkl} c_i^\dag c_j^\dag\langle ij|V|kl \rangle c_l c_k

Note the ordering of the final two destruction operators clckc_l c_k, which is opposite that of the last two single-particle wave functions in the matrix elements of the potential ⟨ij∣V∣kl⟩\langle ij|V|kl\rangle (for bosons it doesn’t matter, for fermions it changes a sign).

Nonrelativistic Propagator

Nonrelativistic limits of the propagators are obtained by assuming ∥p∥/mc≪1\|\mathbf{p}\|/mc \ll 1, and then expressing the propagator using the nonrelativistic energy ω\omega (total energy minus the rest mass energy) by using the well-known relations:

p0c=E=mc2+ωp_0 c = E = mc^2 + \omega
p2c2+m2c4=Ep=mc2+p22m+O(1mc2(p2m)2)\sqrt{{\mathbf{p}}^2c^2 + m^2c^4} = E_{\mathbf{p}} = mc^2+{{\mathbf{p}}^2\over 2m} + O\left({1\over mc^2}\left(p^2\over m\right)^2\right)

we use them to simplify E2−[E]()p2E^2 - [E]()\mathbf{p}^2 in the limit c→∞c \to \infty:

1c2(E2−Ep2)=1c2(E−Ep)(E+Ep)={1\over c^2}(E^2 - E_{\mathbf{p}}^2) = {1\over c^2}(E - E_{\mathbf{p}})(E + E_{\mathbf{p}}) =
=1c2(ω−p22m+O(1mc2(p2m)2))(2mc2+ω+p22m+O(1mc2(p2m)2))== {1\over c^2}\left(\omega-{{\mathbf{p}}^2\over 2m} + O\left({1\over mc^2}\left(p^2\over m\right)^2\right) \right) \left(2mc^2 + \omega + {{\mathbf{p}}^2\over 2m} + O\left({1\over mc^2}\left(p^2\over m\right)^2\right) \right) =
=2m(ω−p22m+ω2mc2(ω−p22m)+O(1mc2(p2m)2))→=2m\left(\omega-{{\mathbf{p}}^2\over 2m} + {\omega\over 2mc^2} \left(\omega-{{\mathbf{p}}^2\over 2m}\right) + O\left({1\over mc^2}\left(p^2\over m\right)^2\right) \right) \to
→2m(ω−p22m)\to 2m\left(\omega-{{\mathbf{p}}^2\over 2m}\right)

Where EE is the total energy, ω\omega is the nonrelativistic energy, EpE_{\mathbf{p}} is the relativistic energy of a noninteracting particle (kinetic energy). Now we can rewrite the propagator of a scalar boson:

D~(p)=ip2−m2c2+iϵ=ip02−p2−m2c2+iϵ=i1c2(p02c2−p2c2−m2c4)+iϵ=\tilde D(p) = {i\over p^2-m^2c^2+i\epsilon} = {i\over p_0^2-{\mathbf{p}}^2-m^2c^2+i\epsilon} = {i\over {1\over c^2}\left(p_0^2c^2-{\mathbf{p}}^2c^2-m^2c^4\right)+i\epsilon} =
=i1c2(E2−Ep2)+iϵ→i2m(ω−p22m)+iϵ== {i\over {1\over c^2}\left(E^2 - E_{\mathbf{p}}^2\right)+i\epsilon} \to {i\over 2m\left(\omega - {{\mathbf{p}}^2\over 2m}\right)+i\epsilon} =
=12miω−p22m+iϵ2m=12miω−p22m+iϵ′= {1\over2m}{i\over\omega-{{\mathbf{p}}^2\over 2m} + i{\epsilon\over 2m}} = {1\over2m}{i\over\omega-{{\mathbf{p}}^2\over 2m} + i\epsilon'}

As you can see, we are interested in the behavior of the propagator in the vicinity of its positive frequency pole ω≈p22m\omega\approx{\mathbf{p}^2\over 2m}.

Similarly for fermions (we set c=1c=1):

S~(p)=i(/p+m)p2−m2+iϵ=i(p0γ0−pjγj+m)p2−m2+iϵ≈12mi(p0γ0−pjγj+m)ω−p22m+iϵ′=\tilde S(p) = {i(\slashed{p}+m)\over p^2-m^2+i\epsilon} = {i(p^0\gamma_0 - p^j\gamma_j+m)\over p^2-m^2+i\epsilon} \approx {1\over2m}{i(p^0\gamma_0 - p^j\gamma_j+m)\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon'} =
=12mi((ω+m)γ0−pjγj+m)ω−p22m+iϵ′≈12mi(mγ0−pjγj+m)ω−p22m+iϵ′== {1\over2m}{i((\omega+m)\gamma_0 - p^j\gamma_j+m)\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon'} \approx {1\over2m}{i(m\gamma_0 - p^j\gamma_j+m)\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon'} =

[

=i(12(γ0+1)−pjγj2m)ω−p22m+iϵ′= {i\left(\frac{1}{2}(\gamma_0+1) - {p^j\gamma_j\over2m}\right)\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon'}

]{label=“fermion-propagator-approx”}

The first term

12(γ0+1)=(1000010000000000)\frac{1}{2}(\gamma_0+1) = \begin{pmatrix}1 & 0 & 0 & 0 \\ 0 & 1 & 0 & 0 \\ 0 & 0 & 0 & 0 \\ 0 & 0 & 0 & 0\end{pmatrix}

selects the two upper components of a given bispinor. The second term

−pjγj2m=(0−pjσj2mpjσj2m0)- {p^j\gamma_j\over2m} = \begin{pmatrix}0 & -{p^j\sigma_j\over2m} \\ {p^j\sigma_j\over2m} & 0\end{pmatrix}

mixes the upper and lower components of the bispinor and the contribution of this term is quadratic in pm{\mathbf{p}\over m} so it can be neglected. The numerator of fermion-propagator-approx{.interpreted-text role=“eq”} reduces to a unit matrix (in spin space):

S~(p)≈i(12(γ0+1)−pjγj2m)ω−p22m+iϵ≈i1ω−p22m+iϵ=1G0+(p,ω)\tilde S(p) \approx {i\left(\frac{1}{2}(\gamma_0+1) - {p^j\gamma_j\over2m}\right)\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon} \approx {i\mathbf{1}\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon} =\mathbf{1} G_0^+({\mathbf{p}}, \omega)

where G0+(p,ω)G_0^+(\mathbf{p}, \omega) is the nonrelativistic retarded propagator defined by:

G0+(x−y)=i∫d3p(2π)3∫dω2πG0+(p,ω)eip⋅(x−y)e−iω(tx−ty)G_0^+(x-y) = i \int {\mathrm{d}^3 p\over (2\pi)^3} \int {\mathrm{d} \omega\over 2\pi} G_0^+({\mathbf{p}}, \omega) e^{i{\mathbf{p}}\cdot({\mathbf{x}-y})} e^{-i\omega(t_x - t_y)}

(For the other pole p0=−sqrtp2+m2p_0 = -sqrt{\mathbf{p}^2+m^2}, we define ω=−p0−m\omega=-p_0-m and we would see that the antiparticles’ propagator reduces to the advanced Green’s function in the nonrelativistic limit.)

As shown above, the nonrelativistic free propagator is defined by:

G0+(x−y)=i∫d3p(2π)3∫dω2πG0+(p,ω)eip⋅(x−y)e−iω(tx−ty)G_0^+(x-y) = i \int {\mathrm{d}^3 p\over (2\pi)^3} \int {\mathrm{d} \omega\over 2\pi} G_0^+({\mathbf{p}}, \omega) e^{i{\mathbf{p}}\cdot({\mathbf{x}-y})} e^{-i\omega(t_x - t_y)}

with:

G0+(p,ω)=iω−p22m+iϵG_0^+({\mathbf{p}}, \omega)= {i\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon}

If we use the energies of the nonineracting particles Ek≡ϵk=ℏ2k22m=k22mE_k \equiv \epsilon_k = {\hbar^2 k^2\over 2m} = {k^2\over 2m}, we can write it as:

G0+(p,ω)=iω−p22m+iϵ=iω−Ek+iϵG_0^+({\mathbf{p}}, \omega)= {i\over \omega-{{\mathbf{p}}^2\over 2m} + i\epsilon} = {i\over \omega-E_k + i\epsilon}

so

G0+(k,ω)=iω−Ek+iϵG_0^+(k, \omega) = {i\over \omega-E_k + i\epsilon}

using E=ℏωE = \hbar\omega we can also write:

G0+(k,E)=iE−Ek+iϵG_0^+(k, E) = {i\over E-E_k + i\epsilon}

Other equivalent ways of representing the propagator:

G0+(x−y)=G0+(x,tx,y,ty)=i∫d3pdE(2πℏ)4G0+(p,E)eiℏp⋅(x−y)e−iℏE(tx−ty)=G_0^+(x-y) = G_0^+({\mathbf{x}}, t_x, {\mathbf{y}}, t_y) = i \int {\mathrm{d}^3 p\mathrm{d} E\over (2\pi\hbar)^4} G_0^+({\mathbf{p}}, E) e^{{i\over\hbar}{\mathbf{p}}\cdot({\mathbf{x}-y})} e^{-{i\over\hbar}E(t_x - t_y)} =
=i∫d3kdω(2π)4G0+(k,ω)eik⋅(x−y)e−iω(tx−ty)= i \int {\mathrm{d}^3 k\mathrm{d} \omega\over (2\pi)^4} G_0^+(k, \omega) e^{i {\mathbf{k}}\cdot({\mathbf{x}-y})} e^{-i\omega(t_x - t_y)}

Sometimes it’s useful to calculate the mixed representation G0+(k,t)G_0^+(k, t):

G0+(k,t)=∫dω2πe−iωtG0+(k,ω)=∫dω2πe−iωtiω−Ek+iϵ=⋯=θte−i(Ek−iϵ)tG_0^+(k, t) = \int {\mathrm{d}\omega\over2\pi}e^{-i\omega t}G_0^+(k, \omega) = \int {\mathrm{d}\omega\over2\pi}e^{-i\omega t} {i\over \omega-E_k + i\epsilon} = \cdots =\theta_t e^{-i (E_k-i\epsilon)t}

(The "⋯\cdots" means to use the Residue Theorem and distinguish two cases t<0t < 0 and t>0t > 0, thus getting the Heaviside step function θt\theta_t in the result.)

Very often, in practice, one just needs to work with G0+(k,t)G_0^+(k, t) and G0+(k,ω)G_0^+(k, \omega), here is how to convert between those:

G0+(k,t)=∫−∞∞dω2πe−iωtG0+(k,ω)G_0^+(k, t) = \int_{-\infty}^\infty {\mathrm{d}\omega\over2\pi}e^{-i\omega t}G_0^+(k, \omega)
G0+(k,ω)=∫−∞∞dt eiωtG0+(k,t)G_0^+(k, \omega) = \int_{-\infty}^\infty \mathrm{d} t\, e^{i\omega t}G_0^+(k, t)

The relation to the contraction of operators is:

G0+(k,t2−t1)=−iθt2−t1⟨Ψ0∣ck(t2)ck†(t1)∣Ψ0⟩G_0^+({\mathbf{k}}, t_2 - t_1) = -i \theta_{t_2-t_1} \langle \Psi_0| c_{\mathbf{k}}(t_2) c_{\mathbf{k}}^\dag(t_1)|\Psi_0 \rangle

where ∣Ψ0⟩|\Psi_0\rangle is the ground state wavefunction and:

ck(t)=eiH0tcke−iH0tc_{\mathbf{k}}(t) = e^{i H_0 t} c_{\mathbf{k}} e^{-i H_0 t}

so to understand the meaning of G0+(k,t2−t1)G_0^+(\mathbf{k}, t_2 - t_1), we write it as:

G0+(k,t2−t1)=−iθt2−t1⟨Ψ0∣ck(t2)ck†(t1)∣Ψ0⟩=−iθt2−t1⟨Ψ0∣eiH0t2cke−iH0(t2−t1)ck†e−iH0t1∣Ψ0⟩=G_0^+({\mathbf{k}}, t_2 - t_1) = -i \theta_{t_2-t_1} \langle \Psi_0| c_{\mathbf{k}}(t_2) c_{\mathbf{k}}^\dag(t_1)|\Psi_0 \rangle = -i \theta_{t_2-t_1} \langle \Psi_0|e^{i H_0 t_2} c_{\mathbf{k}}e^{-i H_0 (t_2-t_1)}c_{\mathbf{k}}^\dag e^{-i H_0 t_1}|\Psi_0 \rangle =
=−iθt2−t1(e−iH0t2∣Ψ0⟩)†(cke−iH0(t2−t1)ck†e−iH0t1∣Ψ0⟩)= -i \theta_{t_2-t_1} \left(e^{-i H_0 t_2}|\Psi_0\rangle\right)^\dag \left( c_{\mathbf{k}}e^{-i H_0 (t_2-t_1)}c_{\mathbf{k}}^\dag e^{-i H_0 t_1}|\Psi_0\rangle \right)

which describes the probability amplitude of adding a bare particle at time t1t_1, removing at time t2t_2 and regaining the original many-body system (that in the meantime evolved into e−iH0t2∣Ψ0⟩e^{-i H_0 t_2}|\Psi_0\rangle).