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Notation and Conventions Used Here

This page records the local notation used in the Wave Mechanics and Model Systems volume. It is a compact orientation guide, not a replacement for the canonical Conventions Overview or the detailed convention pages linked below.

The guiding rule is:

state the convention where ambiguity changes the calculation.\text{state the convention where ambiguity changes the calculation}.

Wave mechanics is especially sensitive to Fourier signs, normalization factors, radial measures, and boundary-condition domains. A page may use a different convention when it has a good reason, but it should say so explicitly and give a translation.

The abstract state is written as a ket ∣ψ⟩\lvert\psi\rangle or, when time dependence matters, ∣ψ(t)⟩\lvert\psi(t)\rangle. Its coordinate-space wavefunction is the position-basis amplitude

ψ(x,t)=⟨x∣ψ(t)⟩\psi(x,t)=\langle x\vert\psi(t)\rangle

in one dimension, and

ψ(r,t)=⟨r∣ψ(t)⟩\psi(\mathbf r,t)=\langle \mathbf r\vert\psi(t)\rangle

in three dimensions. A stationary state is usually written as ψn(x)\psi_n(x), ψE(x)\psi_E(x), or ψnℓm(r)\psi_{n\ell m}(\mathbf r) depending on the spectrum and labels.

The momentum-space wavefunction is written

ϕ(p,t)=⟨p∣ψ(t)⟩\phi(p,t)=\langle p\vert\psi(t)\rangle

in one dimension, or ϕ(p,t)\phi(\mathbf p,t) in three dimensions. Some pages use ψ~(k)\tilde\psi(k) for wave-number amplitudes with p=ℏkp=\hbar k; this is not the same function as ϕ(p)\phi(p) unless the Jacobian has been handled.

Canonical homes:

Operators, Hats, And Differential Expressions

Section titled “Operators, Hats, And Differential Expressions”

Operators may be written with hats, such as H^\hat H, x^\hat x, and p^\hat p, when the distinction between an operator and its eigenvalue or coordinate is helpful. In displayed wave-mechanics equations, the Hamiltonian may also be written as HH when the context is unambiguous.

In position representation, the default one-dimensional momentum operator is

p^=−iℏddx.\hat p=-i\hbar\frac{d}{dx}.

For a scalar potential in one dimension, a common Hamiltonian differential expression is

H^=−ℏ22md2dx2+V(x).\hat H =-\frac{\hbar^2}{2m}\frac{d^2}{dx^2}+V(x).

This expression is not the whole problem. The interval, inner product, and boundary conditions define the operator domain. Use Operator Conventions for sitewide operator notation and Boundary Conditions for the wave-mechanics domain issue.

The default position-momentum Fourier convention uses symmetric factors and keeps ℏ\hbar explicit:

ψ(x)=12πℏ∫−∞∞eipx/ℏϕ(p) dp,\psi(x) = \frac{1}{\sqrt{2\pi\hbar}} \int_{-\infty}^{\infty} e^{ipx/\hbar}\phi(p)\,dp,

and

ϕ(p)=12πℏ∫−∞∞e−ipx/ℏψ(x) dx.\phi(p) = \frac{1}{\sqrt{2\pi\hbar}} \int_{-\infty}^{\infty} e^{-ipx/\hbar}\psi(x)\,dx.

In three dimensions the factor becomes (2πℏ)−3/2(2\pi\hbar)^{-3/2} and pxpx becomes p⋅r\mathbf p\cdot\mathbf r. The canonical convention page is Fourier Transform Conventions; the mathematical tool page is Fourier Transform.

When a page uses wave number kk instead of momentum pp, it should state the convention and remember dp=ℏ dkdp=\hbar\,dk. This is where many apparent normalization disagreements between references originate.

The default convention keeps ℏ\hbar explicit. For example,

iℏ∂ψ∂t=H^ψ,E=ℏω,p=ℏk.i\hbar\frac{\partial\psi}{\partial t}=\hat H\psi, \qquad E=\hbar\omega, \qquad p=\hbar k.

The speed of light cc is kept explicit unless a relativity or field-theory bridge page declares natural units. Atomic units may be used in hydrogenic or quantum-chemistry contexts only after the page states what has been set to one.

Use Units and Constants for the canonical policy.

Wave mechanics uses several normalization conventions. The page should name the convention before interpreting coefficients, amplitudes, or currents.

ObjectDefault ConventionCanonical Home
bound state on a line∫∣ψ(x)∣2 dx=1\int \lvert\psi(x)\rvert^2\,dx=1Normalization Conventions
three-dimensional state∫∣ψ(r)∣2 d3r=1\int \lvert\psi(\mathbf r)\rvert^2\,d^3r=1Wavefunction Normalization
momentum eigenstates⟨p∣p′⟩=δ(p−p′)\langle p\vert p'\rangle=\delta(p-p')Normalization Table
box-normalized plane wavesψn(x)=L−1/2eiknx\psi_n(x)=L^{-1/2}e^{ik_nx}Normalization Conventions
scattering channelsflux or current normalizationReflection and Transmission Coefficients
radial wavefunction R(r)R(r)∫0∞∣R(r)∣2r2 dr=1\int_0^\infty \lvert R(r)\rvert^2r^2\,dr=1Normalization Conventions
reduced radial function u(r)u(r)∫0∞∣u(r)∣2 dr=1\int_0^\infty \lvert u(r)\rvert^2\,dr=1Normalization Table
numerical grid samples∑i∣ψi∣2Δx=1\sum_i\lvert\psi_i\rvert^2\Delta x=1Normalization Table

The distinction between R(r)R(r) and u(r)=rR(r)u(r)=rR(r) should always be stated in central-potential pages.

For a single nonrelativistic particle in a real scalar potential, the default current is

j=ℏ2mi(ψ∗∇ψ−ψ∇ψ∗).\mathbf j = \frac{\hbar}{2mi} \left( \psi^*\nabla\psi - \psi\nabla\psi^* \right).

In one dimension,

j=ℏ2mi(ψ∗∂ψ∂x−ψ∂ψ∗∂x).j = \frac{\hbar}{2mi} \left( \psi^*\frac{\partial\psi}{\partial x} - \psi\frac{\partial\psi^*}{\partial x} \right).

Scattering probabilities are current ratios. For a plane wave AeikxAe^{ikx} with k>0k>0,

j=ℏkm∣A∣2.j=\frac{\hbar k}{m}\lvert A\rvert^2.

Use Probability Current for the formula and interpretation, and Continuity Equation for the conservation-law statement.

With electromagnetic vector potentials, the current changes. Pages using minimal coupling should link to Minimal Coupling in Wave Mechanics and state the sign convention for the charge.

Boundary conditions are written as equations on endpoint values, derivatives, or jumps. For a hard-wall interval 0<x<L0<x<L,

ψ(0)=0,ψ(L)=0.\psi(0)=0, \qquad \psi(L)=0.

For a periodic interval,

ψ(x+L)=ψ(x),ψ′(x+L)=ψ′(x).\psi(x+L)=\psi(x), \qquad \psi'(x+L)=\psi'(x).

Primes denote ordinary derivatives with respect to the displayed coordinate:

ψ′(x)=dψdx.\psi'(x)=\frac{d\psi}{dx}.

A jump across x=ax=a may be written as

ψ′(a+)−ψ′(a−).\psi'(a^+)-\psi'(a^-).

Matching pages should specify which quantities are continuous and which have controlled jumps. Use Boundary Conditions for the conceptual home and Boundary Conditions Table for quick lookup.

Dimensionless variables are introduced to expose the real parameters in a model. A common pattern is

ξ=xL,ϵ=EEL,EL=ℏ22mL2.\xi=\frac{x}{L}, \qquad \epsilon=\frac{E}{E_L}, \qquad E_L=\frac{\hbar^2}{2mL^2}.

For the harmonic oscillator, the natural length is

ℓ=ℏmω,ξ=xℓ.\ell=\sqrt{\frac{\hbar}{m\omega}}, \qquad \xi=\frac{x}{\ell}.

For hydrogenic problems, the natural length is the Bohr radius a0a_0, and radial pages should say whether r/a0r/a_0 or a state-dependent scaled radius is being used.

Use Dimensionless Variables and Scaling for the method and Dimensionless Parameters Table for quick lookup.

Spherical Coordinates And Radial Functions

Section titled “Spherical Coordinates And Radial Functions”

The spherical-coordinate convention is:

r=(r,θ,ϕ),\mathbf r=(r,\theta,\phi),

where r≥0r\ge0, θ\theta is the polar angle from the positive zz axis, and ϕ\phi is the azimuthal angle in the xyxy plane. The volume element is

d3r=r2sin⁡θ dr dθ dϕ,dΩ=sin⁡θ dθ dϕ.d^3r=r^2\sin\theta\,dr\,d\theta\,d\phi, \qquad d\Omega=\sin\theta\,d\theta\,d\phi.

Separated central-potential states are usually written

ψnℓm(r,θ,ϕ)=Rnℓ(r)Yℓm(θ,ϕ),\psi_{n\ell m}(r,\theta,\phi) = R_{n\ell}(r)Y_\ell^m(\theta,\phi),

or, using the reduced radial function,

ψnℓm(r,θ,ϕ)=unℓ(r)rYℓm(θ,ϕ).\psi_{n\ell m}(r,\theta,\phi) = \frac{u_{n\ell}(r)}{r}Y_\ell^m(\theta,\phi).

Angular-momentum pages use the Condon–Shortley phase convention unless they explicitly state otherwise. Use Angular Momentum Conventions and Spherical Harmonics for the canonical angular conventions.

If A Source Uses…Translate Here As…
ψ~(k)\tilde\psi(k) normalized in dkdkcompare with ϕ(p)\phi(p) using p=ℏkp=\hbar k and dp=ℏ dkdp=\hbar\,dk
natural units ℏ=1\hbar=1restore ℏ\hbar in phases, commutators, kinetic terms, and oscillator scales
u(r)u(r) for a radial wavefunctionremember u(r)=rR(r)u(r)=rR(r) and normalize with drdr
amplitudes A,BA,B in scatteringcompute current ratios before calling them probabilities
a box of length LLidentify whether LL is physical or a regulator for continuum normalization
a different spherical-harmonic phasestate the phase convention before comparing matrix elements

These translation points are often more important than algebraic details. Two references may both be correct while using incompatible normalizations or phases.

  • Treating ψ(x)\psi(x) and ϕ(p)\phi(p) as the same wavefunction written with different letters.
  • Mixing kk-space and pp-space Fourier normalizations.
  • Forgetting that ∣ψ(x)∣2\lvert\psi(x)\rvert^2 is a density, not a probability by itself.
  • Dropping the r2sin⁡θr^2\sin\theta measure in spherical coordinates.
  • Comparing scattering amplitudes without velocity or current factors.
  • Using R(r)R(r) and u(r)u(r) interchangeably.
  • Setting ℏ=1\hbar=1 silently in a page that otherwise keeps physical units.
  • D. J. Griffiths and D. F. Schroeter, Introduction to Quantum Mechanics, 3rd ed., Cambridge University Press, 2018.
  • R. Shankar, Principles of Quantum Mechanics, 2nd ed., Springer, 1994.
  • C. Cohen-Tannoudji, B. Diu, and F. Laloë, Quantum Mechanics, Wiley, 1977.
  • D. A. Varshalovich, A. N. Moskalev, and V. K. Khersonskii, Quantum Theory of Angular Momentum, World Scientific, 1988.
  1. A reference defines ψ~(k)\tilde\psi(k) using eikxe^{ikx} and ∫∣ψ~(k)∣2 dk=1\int\lvert\tilde\psi(k)\rvert^2\,dk=1. How should it be compared with a momentum-space wavefunction ϕ(p)\phi(p) normalized in dpdp?
Solution

Use p=ℏkp=\hbar k and dp=ℏ dkdp=\hbar\,dk. The probability must be invariant:

∣ψ~(k)∣2 dk=∣ϕ(p)∣2 dp.\lvert\tilde\psi(k)\rvert^2\,dk = \lvert\phi(p)\rvert^2\,dp.

Therefore ϕ(p)=ψ~(p/ℏ)/ℏ\phi(p)=\tilde\psi(p/\hbar)/\sqrt{\hbar} up to the phase and Fourier-sign conventions used by the reference.

  1. A central-potential calculation says ∫0∞∣u(r)∣2 dr=1\int_0^\infty \lvert u(r)\rvert^2\,dr=1 and also calls u(r)u(r) the radial wavefunction. What convention should be clarified?
Solution

The page should say whether u(r)u(r) is the reduced radial function. In the convention used here, u(r)=rR(r)u(r)=rR(r), where R(r)R(r) is normalized by

∫0∞∣R(r)∣2r2 dr=1.\int_0^\infty \lvert R(r)\rvert^2r^2\,dr=1.

The reduced function u(r)u(r) is normalized with the measure drdr.

  1. In a scattering page, an author writes T=∣Atrans/Ainc∣2T=\lvert A_{\mathrm{trans}}/A_{\mathrm{inc}}\rvert^2 even though the incident and transmitted regions have different wavenumbers. What is missing?
Solution

Transmission should be a current ratio. For plane waves with wavenumbers kLk_L and kRk_R,

T=jtransjinc=kRkL∣Atrans∣2∣Ainc∣2T = \frac{j_{\mathrm{trans}}}{j_{\mathrm{inc}}} = \frac{k_R}{k_L} \frac{\lvert A_{\mathrm{trans}}\rvert^2} {\lvert A_{\mathrm{inc}}\rvert^2}

for equal masses and the standard one-dimensional current convention.