The Schrödinger Equation & the Born Rule

4 hours ~12 min read

De Broglie said matter is a wave; the double slit agreed. But a wave needs a wave equation, and in 1926 Schrödinger wrote it down. This lesson builds the equation the honest way — motivated, not derived — then confronts the question the equation cannot answer: what is Ψ\Psi? Born's answer, that ∣Ψ∣2|\Psi|^2 is a probability density, is the interpretive heart of quantum mechanics. Like a cat in a closed box, Ψ\Psi is never seen directly — only its statistical paw prints.

Learning Objectives

After this lesson you will be able to:

  1. Reconstruct the motivation for the time-dependent Schrödinger equation from the free-particle plane wave and the de Broglie relations, and explain why it is a postulate, not a theorem.
  2. Run the alternative construction — Helmholtz equation ∇2ψ=−k2ψ\nabla^2\psi = -k^2\psi plus k=p/ℏk = p/\hbar — to reach the time-independent Schrödinger equation, and say which route needs a complex ψ\psi and why.
  3. Argue why the wavefunction must be complex, and why linearity implies the superposition principle.
  4. State the Born rule, impose normalization, and identify the conditions an admissible wavefunction must satisfy.
  5. Derive the continuity equation with the probability current jj, and prove that normalization is conserved in time.
  6. Compute expectation values from ∣Ψ∣2|\Psi|^2 and explain the ensemble interpretation, connecting Ψ(x,t)=⟨x∣Ψ(t)⟩\Psi(x,t) = \langle x|\Psi(t)\rangle to the state ket of Term 1.
  7. Show that square-integrable functions form the Hilbert space L2L^2: closure under superposition, a finite inner product, and completeness; and say why plane waves lie outside it.

Intuition

By the end of Course P.3 the verdict is in: an electron sent through two slits builds an interference pattern one dot at a time (P.3.2). Something wavelike, with λ=h/p\lambda = h/p, guides where each dot may land — yet each electron arrives as a single localized dot.

So we need two things. First, a wave equation for the guiding wave Ψ(x,t)\Psi(x,t) — the quantum analogue of Newton's second law, turning an initial condition Ψ(x,0)\Psi(x,0) into Ψ(x,t)\Psi(x,t) for all later times. Second, a rule connecting Ψ\Psi to the dots: the wave is spread out, the detection is pointlike, so the connection must be statistical. Schrödinger supplied the equation, Born the rule. Neither can be deduced from classical physics — they were inspired guesses, and a century of experiments says the guesses were right.


Theory

Constructing the equation (motivated, not derived)

Be clear up front: the Schrödinger equation cannot be derived from anything more fundamental. What follows is the plausibility argument that led to it — a postulate whose only justification is that its predictions have never failed.

Start with the simplest matter wave, a free particle of definite momentum (P.3.2):

Ψ(x,t)=ei(kx−ωt),\Psi(x,t) = e^{i(kx - \omega t)},

and impose the Planck–Einstein and de Broglie relations E=ℏωE = \hbar\omega, p=ℏkp = \hbar k, plus the nonrelativistic dispersion E=p2/2mE = p^2/2m. Differentiate the plane wave and watch the relations become operator statements:

iℏ∂Ψ∂t=iℏ(−iω)Ψ=ℏω Ψ=E Ψ,−ℏ22m∂2Ψ∂x2=−ℏ22m(ik)2Ψ=p22m Ψ.i\hbar\frac{\partial\Psi}{\partial t} = i\hbar(-i\omega)\Psi = \hbar\omega\,\Psi = E\,\Psi, \qquad -\frac{\hbar^2}{2m}\frac{\partial^2\Psi}{\partial x^2} = -\frac{\hbar^2}{2m}(ik)^2\Psi = \frac{p^2}{2m}\,\Psi.

For the free particle E=p2/2mE = p^2/2m forces these to be equal. To include forces, note that classically E=p2/2m+V(x)E = p^2/2m + V(x); the natural generalization — the leap of faith — adds the potential as a multiplicative term:

  iℏ∂Ψ∂t=−ℏ22m∂2Ψ∂x2+V(x) Ψ  \boxed{\;i\hbar\frac{\partial\Psi}{\partial t} = -\frac{\hbar^2}{2m}\frac{\partial^2\Psi}{\partial x^2} + V(x)\,\Psi\;}

This is the time-dependent Schrödinger equation. Every step was suggestive: we assumed the plane-wave form and the dispersion, then declared the result valid for all Ψ\Psi and all VV. That declaration is the postulate; electron diffraction, atomic spectra (Course P.6), and tunneling (Course P.5) are its validation.

A second route: de Broglie → Helmholtz → Schrödinger

The construction above goes through time. There is a shorter road that never mentions tt at all, and it is worth walking because it reaches the time-independent equation directly, using only classical wave machinery and one substitution.

Restrict attention to waves of a single wavelength λ\lambda — monochromatic waves. Any such wave in one dimension satisfies the Helmholtz equation

d2ψdz2=−k2ψ,k=2πλ, \frac{d^2\psi}{dz^2} = -k^2\psi, \qquad k = \frac{2\pi}{\lambda},

whose solutions are exactly the wave shapes we already know work: sin⁡kz\sin kz, cos⁡kz\cos kz, eikze^{ikz} (and their negative-kk partners). It is nothing but "curvature proportional to minus the function" — the defining property of a sinusoid of wavelength λ\lambda. In three dimensions the same statement uses the Laplacian of P.1.2:

∇2ψ≡∂2ψ∂x2+∂2ψ∂y2+∂2ψ∂z2=−k2ψ, \nabla^2\psi \equiv \frac{\partial^2\psi}{\partial x^2} + \frac{\partial^2\psi}{\partial y^2} + \frac{\partial^2\psi}{\partial z^2} = -k^2\psi ,

with solutions sin⁡(k⋅r)\sin(\mathbf k\cdot\mathbf r), cos⁡(k⋅r)\cos(\mathbf k\cdot\mathbf r), eik⋅re^{i\mathbf k\cdot\mathbf r}. So far this is classical optics: no quantum mechanics has entered, and kk is just a number describing how tightly the wave ripples.

Now insert de Broglie. His hypothesis λ=h/p\lambda = h/p (P.3.2) converts the geometric quantity kk into a mechanical one:

k=2πλ=2πph=pℏ,where  ℏ≡h2π ⟹k2=p2ℏ2. k = \frac{2\pi}{\lambda} = \frac{2\pi p}{h} = \frac{p}{\hbar}, \qquad \text{where } \boxed{\ \hbar \equiv \frac{h}{2\pi}\ } \qquad\Longrightarrow\qquad k^2 = \frac{p^2}{\hbar^2}.

That single substitution is the entire quantum content. Feed it back into Helmholtz and multiply by −ℏ2-\hbar^2:

∇2ψ=−p2ℏ2 ψ⟺−ℏ2∇2ψ=p2ψ. \nabla^2\psi = -\frac{p^2}{\hbar^2}\,\psi \qquad\Longleftrightarrow\qquad -\hbar^2\nabla^2\psi = p^2\psi .

The right-hand side is begging to be an energy. Divide by twice the particle's mass:

−ℏ22m∇2ψ=p22m ψ, -\frac{\hbar^2}{2m}\nabla^2\psi = \frac{p^2}{2m}\,\psi ,

and recognize p2/2mp^2/2m from classical mechanics as the kinetic energy. The last step is the same leap of faith as before, in a cleaner disguise: classically the total energy splits as E=kinetic+potentialE = \text{kinetic} + \text{potential}, so

p22m=E−V(r)⟹−ℏ22m∇2ψ=(E−V(r))ψ, \frac{p^2}{2m} = E - V(\mathbf r) \qquad\Longrightarrow\qquad -\frac{\hbar^2}{2m}\nabla^2\psi = \big(E - V(\mathbf r)\big)\psi ,

or, collecting the operator on the left,

  (−ℏ22m∇2+V(r))ψ=E ψ   \boxed{\;\left(-\frac{\hbar^2}{2m}\nabla^2 + V(\mathbf r)\right)\psi = E\,\psi\;}

— the time-independent Schrödinger equation, valid (we now postulate) for a particle of any mass mm in any potential V(r)V(\mathbf r). Its solutions and their dynamics are the whole subject of P.4.2, and Courses P.5–P.6 are nothing but this equation with different VV.

flowchart TD
    A["Free plane wave in space and time"] --> B["E = ℏω, p = ℏk<br/>plus dispersion E = p²/2m"]
    B --> C["Time-dependent SE<br/>iℏ ∂Ψ/∂t = ĤΨ"]
    D["Monochromatic wave, one λ"] --> E["Helmholtz: ∇²ψ = −k²ψ"]
    E --> F["de Broglie: k = p/ℏ<br/>so −ℏ²∇²ψ = p²ψ"]
    F --> G["÷2m, then p²/2m = E − V"]
    G --> H["Time-independent SE<br/>Ĥψ = Eψ"]
    C --> |"separate variables (P.4.2)"| H
    H --> |"× exp(−iEt/ℏ)"| C

Two honest observations about this second route. First, it is still a postulate: the substitution k=p/ℏk = p/\hbar was justified only for a free particle of definite momentum, and writing E−V(r)E - V(\mathbf r) with a position-dependent VV silently assumes a local wavelength that varies from place to place — plausible, unproven, and correct. Second, notice what is missing: no ii, no time derivative. The Helmholtz route never forces ψ\psi to be complex, because sin⁡\sin and cos⁡\cos solve it perfectly well. Complexity is forced only by the demand for time evolution that is first order in tt — the argument of the next section. The two routes are complementary: one gives the dynamics and pays for it with ii; the other gives the spectrum for free.

Why Ψ\Psi must be complex

The ii is forced, not decorative. Suppose we wanted a real equation, first order in time (first order, so Ψ(x,0)\Psi(x,0) alone fixes the future): ∂tΨ=α ∂x2Ψ\partial_t\Psi = \alpha\,\partial_x^2\Psi with real α\alpha. Try a traveling wave Ψ=cos⁡(kx−ωt)\Psi = \cos(kx - \omega t): the left side is ωsin⁡(kx−ωt)\omega\sin(kx-\omega t), the right is −αk2cos⁡(kx−ωt)-\alpha k^2\cos(kx-\omega t), and sine and cosine of the same argument are linearly independent — no choice of constants works. A real first-order-in-time equation cannot carry a traveling wave (with real α\alpha it is the diffusion equation: spreading and decay, never propagation). The classical wave equation of P.1.1 escapes by being second order in time — but then E=ℏωE = \hbar\omega would require E2∝p2E^2 \propto p^2, the wrong (relativistic) dispersion. The only way to be first order in time and propagate is to let Ψ\Psi be complex, so ei(kx−ωt)e^{i(kx-\omega t)} — packaging cos⁡\cos and sin⁡\sin together — is a solution. Complex amplitudes are structural, just as in 1.1.1 The State Postulate.

Linearity and superposition

The equation is linear: if Ψ1,Ψ2\Psi_1, \Psi_2 are solutions, so is c1Ψ1+c2Ψ2c_1\Psi_1 + c_2\Psi_2 for any complex c1,c2c_1, c_2 (every term acts linearly; substitute and check). This is the superposition principle — the same structure that made classical waves interfere in P.1.1, and the same principle elevated to Postulate 1 in 1.1.1. Matter-wave interference, and every quantum algorithm, lives in this linearity.

The Born rule

The equation evolves Ψ\Psi; it does not say what Ψ\Psi means. Born's statistical interpretation (1926) supplies the link to experiment:

Born rule. ∣Ψ(x,t)∣2 dx|\Psi(x,t)|^2\,dx is the probability of finding the particle in [x,x+dx][x, x+dx] if position is measured at time tt: ρ=∣Ψ∣2\rho = |\Psi|^2 is a probability density, and P(a<x<b)=∫ab∣Ψ(x,t)∣2 dxP(a<x<b) = \int_a^b |\Psi(x,t)|^2\,dx.

Total probability must be one, which imposes normalization:

∫−∞∞∣Ψ(x,t)∣2 dx=1.\int_{-\infty}^{\infty} |\Psi(x,t)|^2\,dx = 1.

By linearity, AΨA\Psi solves the equation whenever Ψ\Psi does; normalization fixes ∣A∣|A| (the phase of AA is the unobservable global phase of 1.1.1). This selects the admissible wavefunctions:

  • Square-integrable: ∫∣Ψ∣2dx<∞\int|\Psi|^2dx < \infty; in particular Ψ→0\Psi \to 0 as x→±∞x \to \pm\infty.
  • Continuous everywhere, with ∂Ψ/∂x\partial\Psi/\partial x continuous wherever VV is finite (integrating the equation across a point shows a kink in Ψ′\Psi' needs an infinite VV, as in the idealized wells of P.5.2).
  • Non-normalizable solutions like eikxe^{ikx} are not physical states — they are idealized basis functions, handled honestly in P.4.3 and P.5.1.

Conservation of probability: the continuity equation

Normalizing at t=0t=0 would be useless if evolution destroyed it. It doesn't. Take the Schrödinger equation and its complex conjugate (with VV real):

∂Ψ∂t=iℏ2m∂2Ψ∂x2−iℏVΨ,∂Ψ∗∂t=−iℏ2m∂2Ψ∗∂x2+iℏVΨ∗.\frac{\partial\Psi}{\partial t} = \frac{i\hbar}{2m}\frac{\partial^2\Psi}{\partial x^2} - \frac{i}{\hbar}V\Psi, \qquad \frac{\partial\Psi^*}{\partial t} = -\frac{i\hbar}{2m}\frac{\partial^2\Psi^*}{\partial x^2} + \frac{i}{\hbar}V\Psi^*.

Differentiate the density ρ=Ψ∗Ψ\rho = \Psi^*\Psi; the potential terms cancel identically:

∂ρ∂t=Ψ∗∂Ψ∂t+∂Ψ∗∂tΨ=iℏ2m(Ψ∗∂2Ψ∂x2−∂2Ψ∗∂x2Ψ)=∂∂x[iℏ2m(Ψ∗∂Ψ∂x−∂Ψ∗∂xΨ)],\frac{\partial\rho}{\partial t} = \Psi^*\frac{\partial\Psi}{\partial t} + \frac{\partial\Psi^*}{\partial t}\Psi = \frac{i\hbar}{2m}\left(\Psi^*\frac{\partial^2\Psi}{\partial x^2} - \frac{\partial^2\Psi^*}{\partial x^2}\Psi\right) = \frac{\partial}{\partial x}\left[\frac{i\hbar}{2m}\left(\Psi^*\frac{\partial\Psi}{\partial x} - \frac{\partial\Psi^*}{\partial x}\Psi\right)\right],

where the last step is checked by expanding the derivative (the Ψ′∗Ψ′\Psi'^*\Psi' cross terms cancel). Hence the continuity equation

∂ρ∂t+∂j∂x=0,j≡iℏ2m(Ψ∂Ψ∗∂x−Ψ∗∂Ψ∂x)=ℏm Im ⁣(Ψ∗∂Ψ∂x):\frac{\partial\rho}{\partial t} + \frac{\partial j}{\partial x} = 0, \qquad j \equiv \frac{i\hbar}{2m}\left(\Psi\frac{\partial\Psi^*}{\partial x} - \Psi^*\frac{\partial\Psi}{\partial x}\right) = \frac{\hbar}{m}\,\mathrm{Im}\!\left(\Psi^*\frac{\partial\Psi}{\partial x}\right):

probability is locally conserved, flowing with current density jj like charge in electromagnetism. Integrating over all space,

ddt∫−∞∞∣Ψ∣2 dx=−∫−∞∞∂j∂x dx=−[j]−∞∞=0,\frac{d}{dt}\int_{-\infty}^{\infty}|\Psi|^2\,dx = -\int_{-\infty}^{\infty}\frac{\partial j}{\partial x}\,dx = -\big[j\big]_{-\infty}^{\infty} = 0,

since Ψ→0\Psi \to 0 at ±∞\pm\infty kills jj there. Normalize once, stay normalized. In Term 1 language: evolution is unitary — this is the wave-mechanics face of 1.1.3 The Evolution Postulate.

Expectation values and the ensemble interpretation

Since ∣Ψ∣2|\Psi|^2 is a probability density, averages follow ordinary probability theory (0.2.2):

⟨x⟩=∫−∞∞x ∣Ψ(x,t)∣2 dx,⟨f(x)⟩=∫−∞∞f(x) ∣Ψ(x,t)∣2 dx.\langle x\rangle = \int_{-\infty}^{\infty} x\,|\Psi(x,t)|^2\,dx, \qquad \langle f(x)\rangle = \int_{-\infty}^{\infty} f(x)\,|\Psi(x,t)|^2\,dx.

Read ⟨x⟩\langle x\rangle carefully: it is not the average of repeated measurements on one particle — the first measurement collapses the state, and re-measuring just repeats the same value. It is the average over an ensemble: many systems, all identically prepared in Ψ\Psi, each measured once. This is the operational reading formalized in 1.1.2 Observables & the Measurement Postulate.

Wavefunctions form a Hilbert space

Square-integrability is more than a technical condition. It gives the admissible wavefunctions exactly the structure Term 1 takes as its starting point. Let L2(R)L^2(\mathbb R) be the set of complex functions ff with ∫−∞∞∣f∣2 dx<∞\int_{-\infty}^{\infty}|f|^2\,dx < \infty.

It is a vector space. Multiplying by a constant keeps a function in L2L^2, and so does adding two of them, because of the pointwise inequality ∣f+g∣2≤2∣f∣2+2∣g∣2|f + g|^2 \le 2|f|^2 + 2|g|^2 (expand ∣f−g∣2≥0|f - g|^2 \ge 0 to get 2 Re(f∗g)≤∣f∣2+∣g∣22\,\mathrm{Re}(f^*g) \le |f|^2 + |g|^2). Superpositions of admissible wavefunctions are admissible: the linearity of the equation and the structure of the state space fit together.

It carries an inner product.

⟨f,g⟩=∫−∞∞f∗(x) g(x) dx. \langle f, g\rangle = \int_{-\infty}^{\infty} f^*(x)\,g(x)\,dx .

This is finite for every f,g∈L2f, g \in L^2. The product f∗gf^*g need not itself be square-integrable, but it is integrable, since ∣f∗g∣≤12(∣f∣2+∣g∣2)|f^*g| \le \tfrac12\big(|f|^2 + |g|^2\big); more sharply, ∣⟨f,g⟩∣≤∥f∥ ∥g∥|\langle f, g\rangle| \le \lVert f\rVert\,\lVert g\rVert with ∥f∥=⟨f,f⟩\lVert f\rVert = \sqrt{\langle f, f\rangle}, the Cauchy–Schwarz inequality of 0.1.2. It has the three defining properties: conjugate symmetry ⟨f,g⟩=⟨g,f⟩∗\langle f, g\rangle = \langle g, f\rangle^*; linearity in the second slot, ⟨f,αg1+βg2⟩=α⟨f,g1⟩+β⟨f,g2⟩\langle f, \alpha g_1 + \beta g_2\rangle = \alpha\langle f, g_1\rangle + \beta\langle f, g_2\rangle (so it is antilinear in the first, ⟨αf,g⟩=α∗⟨f,g⟩\langle\alpha f, g\rangle = \alpha^*\langle f, g\rangle); and positivity, ⟨f,f⟩≥0\langle f, f\rangle \ge 0 with equality only for f=0f = 0. (Strictly, "f=0f = 0 except on a set of zero total length": functions that differ only there are identified, since no measurement can tell them apart.)

It is complete. Every Cauchy sequence of square-integrable functions converges in norm to a square-integrable function (the Riesz–Fischer theorem). A complete inner-product space is a Hilbert space, and L2L^2 is the prototype.

Everything in this lesson is now a statement in that space. Normalization is ∥Ψ∥=1\lVert\Psi\rVert = 1, conserved because evolution preserves the norm; the overlaps ⟨ψn,Ψ⟩\langle\psi_n, \Psi\rangle that P.4.2 uses to expand a state in energy eigenfunctions are inner products; in Dirac notation (0.1.3) ⟨f,g⟩\langle f, g\rangle is written ⟨f∣g⟩\langle f|g\rangle. The idealizations live outside the space: neither the plane wave eikxe^{ikx} nor the position eigenfunction δ(x−x0)\delta(x - x_0) is square-integrable. They are indispensable as limits and as labels for continuous expansions, where sums become integrals, but making them rigorous needs an enlarged ("rigged") Hilbert space, beyond this program. For the finite-dimensional systems of Term 1 none of these subtleties arise: every Cn\mathbb C^n is a Hilbert space as it stands.

The bridge to Term 1: Ψ(x,t)=⟨x∣Ψ(t)⟩\Psi(x,t) = \langle x|\Psi(t)\rangle

Everything in this term connects to the main program through one identity. Term 1 describes the state as an abstract ket ∣Ψ(t)⟩\lvert\Psi(t)\rangle (1.1.1); the wavefunction is its expansion in the continuum basis of position states:

Ψ(x,t)=⟨x∣Ψ(t)⟩.\Psi(x,t) = \langle x|\Psi(t)\rangle.

The wavefunction is the position representation of the ket — the continuous analogue of listing a qubit's components ⟨0∣ψ⟩,⟨1∣ψ⟩\langle 0|\psi\rangle, \langle 1|\psi\rangle. Normalization is ⟨Ψ∣Ψ⟩=1\langle\Psi|\Psi\rangle = 1; the position Born rule is the general Born rule in the position basis. Schrödinger's wave mechanics and Heisenberg's matrix mechanics looked like rival theories in 1926; they are the same theory in different bases — a change of basis in the sense of 0.1.4. Momentum space gives a third face of the same object (P.4.3).

Caution. Ψ\Psi itself is not measurable and is not a physical wave in ordinary space. No instrument reads off Ψ(x,t)\Psi(x,t); only Born-rule quantities — ∣Ψ∣2|\Psi|^2, probabilities, expectation values — touch experiment. And for NN particles, Ψ(r1,…,rN,t)\Psi(\mathbf r_1,\dots,\mathbf r_N,t) lives in 3N3N-dimensional configuration space, not in the 3D space around you: it cannot be a ripple in any ordinary medium. Treating Ψ\Psi as a classical field in real space is the most common misreading of wave mechanics.


Worked Examples

Example 1 — Normalizing a Gaussian and using the Born rule

Let Ψ(x,0)=A e−x2/4a2\Psi(x,0) = A\,e^{-x^2/4a^2}, a>0a>0. Normalize, then find P(−a<x<a)P(-a<x<a).

Using ∫−∞∞e−λx2dx=π/λ\int_{-\infty}^{\infty} e^{-\lambda x^2}dx = \sqrt{\pi/\lambda}:

1=∣A∣2∫−∞∞e−x2/2a2dx=∣A∣22π a  ⇒  A=(2πa2)−1/4.1 = |A|^2\int_{-\infty}^{\infty} e^{-x^2/2a^2}dx = |A|^2\sqrt{2\pi}\,a \;\Rightarrow\; A = (2\pi a^2)^{-1/4}.

Then ∣Ψ∣2=12π ae−x2/2a2|\Psi|^2 = \frac{1}{\sqrt{2\pi}\,a}e^{-x^2/2a^2} — a normal density with standard deviation aa — so P(−a<x<a)=erf(1/2)≈0.6827P(-a<x<a) = \mathrm{erf}(1/\sqrt2) \approx 0.6827, the familiar "one sigma" mass. By symmetry ⟨x⟩=0\langle x\rangle = 0, and ⟨x2⟩=a2\langle x^2\rangle = a^2.

Example 2 — Probability current of a plane wave and of a real wavefunction

(a) For Ψ=A ei(kx−ωt)\Psi = A\,e^{i(kx-\omega t)} (idealized, non-normalizable):

j=ℏm Im(Ψ∗∂xΨ)=ℏm Im(∣A∣2ik)=∣A∣2 ℏkm=ρ pm:j = \frac{\hbar}{m}\,\mathrm{Im}\big(\Psi^*\partial_x\Psi\big) = \frac{\hbar}{m}\,\mathrm{Im}\big(|A|^2 ik\big) = |A|^2\,\frac{\hbar k}{m} = \rho\,\frac{p}{m}:

density times the classical velocity p/mp/m — a steady rightward flow, consistent with ∂tρ=0=∂xj\partial_t\rho = 0 = \partial_x j.

(b) If Ψ=ψ(x)e−iEt/ℏ\Psi = \psi(x)e^{-iEt/\hbar} with ψ\psi real, then Ψ∗∂xΨ=ψψ′\Psi^*\partial_x\Psi = \psi\psi' is real and j=0j = 0 everywhere: real-up-to-a-phase wavefunctions carry no probability flow. Bound states are of this type — nothing flows in a stationary state (P.4.2).


Hands-on (Python)

import numpy as np
import matplotlib.pyplot as plt

# --- Normalize a packet, apply the Born rule, then SAMPLE from it ------------
x = np.linspace(-20, 20, 4001); dx = x[1] - x[0]
psi = np.exp(-x**2 / 4) * np.exp(2j * x)      # unnormalized Gaussian packet, k0 = 2

psi /= np.sqrt(np.trapz(np.abs(psi)**2, x))   # normalize with np.trapz
print(np.trapz(np.abs(psi)**2, x))            # 1.0 (normalized)

a, b = -1.0, 1.0                              # Born rule: P(a < x < b)
m_ab = (x >= a) & (x <= b)
print(np.trapz(np.abs(psi[m_ab])**2, x[m_ab]))  # ≈ 0.6827 (1σ Gaussian mass)

# Born rule as a sampling recipe: draw synthetic position measurements
rho = np.abs(psi)**2
samples = np.random.default_rng(0).choice(x, size=20000, p=rho*dx/np.sum(rho*dx))
plt.hist(samples, bins=80, density=True, alpha=0.5, label="measured positions")
plt.plot(x, rho, "k", label=r"$|\Psi|^2$"); plt.xlim(-6, 6); plt.legend(); plt.show()
# Expected: histogram hugs the density — dots build the wave's statistics.
from scipy.linalg import solve_banded

# --- Crank–Nicolson: Gaussian in a harmonic trap; the norm stays 1 -----------
# Numerical values hbar = m = 1 (physics keeps ħ explicit; arrays don't care).
hbar, m, w = 1.0, 1.0, 1.0
xg = np.linspace(-10, 10, 1200); dxg = xg[1]-xg[0]; dt = 0.002
V = 0.5 * m * w**2 * xg**2
psi_t = ((1/np.pi)**0.25 * np.exp(-(xg-2.0)**2/2)).astype(complex)  # displaced Gaussian

# Tridiagonal H = -(ħ²/2m)d²/dx² + V; CN step: (1 + i dt H/2ħ) ψ' = (1 - i dt H/2ħ) ψ
main = hbar**2/(m*dxg**2) + V
off  = -hbar**2/(2*m*dxg**2) * np.ones(len(xg)-1)
ab = np.zeros((3, len(xg)), dtype=complex)    # banded form of (1 + i dt H/2ħ)
ab[0,1:], ab[1,:], ab[2,:-1] = (1j*dt/(2*hbar)*off, 1 + 1j*dt/(2*hbar)*main,
                                1j*dt/(2*hbar)*off)
norm0 = np.trapz(np.abs(psi_t)**2, xg)
for _ in range(2000):                         # evolve to t = 4
    Hpsi = (main*psi_t + np.concatenate(([0], off*psi_t[:-1]))
                       + np.concatenate((off*psi_t[1:], [0])))
    psi_t = solve_banded((1, 1), ab, psi_t - 1j*dt/(2*hbar)*Hpsi)
print(norm0, np.trapz(np.abs(psi_t)**2, xg))
# Expected: 1.0 1.0000000000000... — Crank–Nicolson is unitary, so the norm is
# conserved to machine precision, the discrete shadow of d/dt ∫|Ψ|²dx = 0.

Exercises

E1 (easy). Normalize Ψ(x,0)=Ae−∣x∣/a\Psi(x,0) = A e^{-|x|/a} (a>0a>0) and compute P(x>a)P(x>a).

Solution

1=∣A∣2∫−∞∞e−2∣x∣/adx=∣A∣2⋅2⋅a2=∣A∣2a1 = |A|^2\int_{-\infty}^{\infty}e^{-2|x|/a}dx = |A|^2\cdot 2\cdot\tfrac a2 = |A|^2a, so A=1/aA = 1/\sqrt a. Then P(x>a)=1a∫a∞e−2x/adx=12e−2≈0.0677P(x>a) = \tfrac1a\int_a^\infty e^{-2x/a}dx = \tfrac12 e^{-2} \approx 0.0677.

E2 (easy). Show directly that if Ψ1,Ψ2\Psi_1, \Psi_2 solve the time-dependent Schrödinger equation, so does c1Ψ1+c2Ψ2c_1\Psi_1 + c_2\Psi_2. Which property of the equation is responsible?

Solution

With H^=−ℏ22m∂x2+V\hat H = -\frac{\hbar^2}{2m}\partial_x^2 + V: iℏ∂t(c1Ψ1+c2Ψ2)=c1iℏ∂tΨ1+c2iℏ∂tΨ2=c1H^Ψ1+c2H^Ψ2=H^(c1Ψ1+c2Ψ2)i\hbar\partial_t(c_1\Psi_1 + c_2\Psi_2) = c_1 i\hbar\partial_t\Psi_1 + c_2 i\hbar\partial_t\Psi_2 = c_1\hat H\Psi_1 + c_2\hat H\Psi_2 = \hat H(c_1\Psi_1 + c_2\Psi_2), because differentiation and multiplication by V(x)V(x) are linear. The property is linearity — the superposition principle.

E3 (medium). Redo the conservation calculation for a complex potential V=V0−iΓV = V_0 - i\Gamma (V0,ΓV_0, \Gamma real, Γ>0\Gamma>0) and show ddt∫∣Ψ∣2dx=−2Γℏ∫∣Ψ∣2dx\frac{d}{dt}\int|\Psi|^2dx = -\frac{2\Gamma}{\hbar}\int|\Psi|^2dx, so the norm decays as e−2Γt/ℏe^{-2\Gamma t/\hbar}. What could this model?

Solution

The potential terms in ∂tρ\partial_t\rho no longer cancel: −iℏ(V−V∗)∣Ψ∣2=−2Γℏ∣Ψ∣2-\tfrac{i}{\hbar}(V - V^*)|\Psi|^2 = -\tfrac{2\Gamma}{\hbar}|\Psi|^2. The current term still integrates to zero, so ddt∫∣Ψ∣2dx=−2Γℏ∫∣Ψ∣2dx\frac{d}{dt}\int|\Psi|^2dx = -\frac{2\Gamma}{\hbar}\int|\Psi|^2dx, giving exponential decay with lifetime τ=ℏ/2Γ\tau = \hbar/2\Gamma. It models absorption or decay (an unstable particle, a beam eaten by a detector). Real potentials — Hermitian Hamiltonians — are exactly what probability conservation requires.

E4 (medium). For Ψ=(Aeikx+Be−ikx)e−iℏk2t/2m\Psi = \big(Ae^{ikx} + Be^{-ikx}\big)e^{-i\hbar k^2t/2m}, compute jj and interpret each term.

Solution

With ψ=Aeikx+Be−ikx\psi = Ae^{ikx} + Be^{-ikx}: ψ∗∂xψ=ik(∣A∣2−∣B∣2)+ik(A∗Be−2ikx−AB∗e2ikx)\psi^*\partial_x\psi = ik\big(|A|^2 - |B|^2\big) + ik\big(A^*Be^{-2ikx} - AB^*e^{2ikx}\big). The second bracket is 2i Im(A∗Be−2ikx)2i\,\mathrm{Im}(A^*Be^{-2ikx}), purely imaginary, so times ikik it is real and drops from Im\mathrm{Im}. Hence j=ℏkm(∣A∣2−∣B∣2)j = \frac{\hbar k}{m}(|A|^2 - |B|^2): rightward flow minus leftward flow, with no interference in the net current — the calculation behind reflection and transmission coefficients in P.5.2.

E5 (hard). Prove d⟨x⟩dt=∫−∞∞j dx\frac{d\langle x\rangle}{dt} = \int_{-\infty}^{\infty} j\,dx (use the continuity equation and integrate by parts). Evaluate it for the plane wave of Example 2(a) on a large box of length LL with ∣A∣2=1/L|A|^2 = 1/L, and interpret.

Solution

d⟨x⟩dt=∫x ∂tρ dx=−∫x ∂xj dx=−[xj]−∞∞+∫j dx=∫j dx\frac{d\langle x\rangle}{dt} = \int x\,\partial_t\rho\,dx = -\int x\,\partial_xj\,dx = -[xj]_{-\infty}^{\infty} + \int j\,dx = \int j\,dx, the boundary term vanishing because square-integrability makes j→0j \to 0 faster than 1/x1/x. For the boxed plane wave, ∫0Lj dx=1L⋅ℏkm⋅L=ℏkm=pm\int_0^L j\,dx = \frac1L\cdot\frac{\hbar k}{m}\cdot L = \frac{\hbar k}{m} = \frac pm: the mean position moves at the classical velocity — foreshadowing the group velocity and Ehrenfest's theorem of P.4.3.


Checkpoint

  1. In what precise sense is the Schrödinger equation "not derived"? What inputs motivated its form?
  2. Starting from the Helmholtz equation ∇2ψ=−k2ψ\nabla^2\psi = -k^2\psi, use de Broglie to reach the time-independent Schrödinger equation. Where exactly does the postulate enter, and why does this route never force ψ\psi to be complex?
  3. Why can't the wavefunction be a real function obeying a first-order-in-time equation?
  4. State the Born rule and the admissibility conditions on Ψ\Psi.
  5. Write the continuity equation and the probability current, and explain why normalizing once suffices forever.
  6. What does ⟨x⟩\langle x\rangle mean operationally — and what does it not mean?
  7. Why is the inner product of two square-integrable functions always finite, and what makes L2L^2 a Hilbert space? Is eikxe^{ikx} in it?
Answers
  1. It is a postulate, not deducible from classical physics. Its form was motivated by requiring the plane wave ei(kx−ωt)e^{i(kx-\omega t)} with E=ℏωE = \hbar\omega, p=ℏkp = \hbar k to satisfy E=p2/2mE = p^2/2m, then generalizing E→p2/2m+VE \to p^2/2m + V and promoting the result to all Ψ\Psi, all VV. Experiment is its only justification.
  2. k=2π/λk = 2\pi/\lambda with λ=h/p\lambda = h/p gives k=p/ℏk = p/\hbar, so ∇2ψ=−(p2/ℏ2)ψ\nabla^2\psi = -(p^2/\hbar^2)\psi, i.e. −ℏ2∇2ψ=p2ψ-\hbar^2\nabla^2\psi = p^2\psi; dividing by 2m2m makes the right side the kinetic energy, and substituting p2/2m=E−V(r)p^2/2m = E - V(\mathbf r) gives (−ℏ22m∇2+V)ψ=Eψ\big({-}\tfrac{\hbar^2}{2m}\nabla^2 + V\big)\psi = E\psi. The postulate enters at that last substitution: k=p/ℏk = p/\hbar was justified only for a free particle of definite momentum, yet we apply it where VV — and hence the local wavelength — varies with position, then declare the result valid for every VV and every ψ\psi. Nothing here needs complex numbers because sin⁡\sin and cos⁡\cos solve Helmholtz perfectly well; only the demand for first-order-in-time evolution forces Ψ∈C\Psi \in \mathbb{C} (next question).
  3. A single real function first order in time gives the diffusion equation, which spreads but cannot propagate; traveling waves need cos⁡\cos and sin⁡\sin exchanging roles, i.e. a complex exponential. Hence Ψ∈C\Psi \in \mathbb{C} is forced.
  4. ∣Ψ(x,t)∣2dx|\Psi(x,t)|^2dx = probability of finding the particle in [x,x+dx][x,x+dx]. Admissible: square- integrable (Ψ→0\Psi \to 0 at ±∞\pm\infty), continuous, Ψ′\Psi' continuous wherever VV is finite.
  5. ∂tρ+∂xj=0\partial_t\rho + \partial_xj = 0 with j=ℏmIm(Ψ∗∂xΨ)j = \frac{\hbar}{m}\mathrm{Im}(\Psi^*\partial_x\Psi). Integrating over all space turns the current term into a vanishing boundary term, so ddt∫∣Ψ∣2dx=0\frac{d}{dt}\int|\Psi|^2dx = 0: the norm is a constant of the motion.
  6. The mean of single position measurements over an ensemble of identically prepared systems — not the average of repeated measurements on one system, which the first measurement's collapse would spoil.
  7. Pointwise, ∣f∗g∣≤12(∣f∣2+∣g∣2)|f^*g| \le \tfrac12(|f|^2 + |g|^2), so f∗gf^*g is integrable (Cauchy–Schwarz gives the sharper bound ∥f∥∥g∥\lVert f\rVert\lVert g\rVert). L2L^2 is a vector space with this inner product and is complete (Riesz–Fischer), which is the definition of a Hilbert space. eikxe^{ikx} is not in it: ∫∣eikx∣2dx=∫dx\int|e^{ikx}|^2dx = \int dx diverges.

Further Reading

  • [Gri] Griffiths & Schroeter, §1.1–1.4 — the equation, the statistical interpretation, normalization.
  • [Gri] Griffiths & Schroeter, §1.5 — expectation values and conservation of probability.
  • [ER] Eisberg & Resnick, Ch. 5 — the plausibility construction of the Schrödinger equation, in loving detail.
  • [Sha] Shankar, §4.1–4.2 — the postulates of wave mechanics, bridging to the abstract formalism.
  • [NC] Nielsen & Chuang, §2.2.3 — the Born rule in its general, basis-independent form.

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