Notation

The HOOMD-blue documentation uses the following mathematical notation.

General notation:

xx

Scalar.

a⃗\vec{a}

Vector.

aa

Magnitude of the vector a⃗\vec{a}.

a^\hat{a}

Unit vector in the direction of a⃗\vec{a}.

A\mathbf{A}

Matrix.

b\mathbf{b}

Quaternion.

∣b∣\vert \mathbf{b} \vert

Magnitude of a quaternion.

ii, jj, kk

Indices.

ii

−1\sqrt{-1} in some contexts.

function\mathrm{function}

A mathematical function.

a [length]2[\mathrm{length}]^2

The quantity “a” has dimensions of length2\mathrm{length}^2.

Symbol definitions:

v⃗ij\vec{v}_{ij}

v⃗j−v⃗j\vec{v}_j - \vec{v}_j

r⃗\vec{r}

Position.

v⃗\vec{v}

Velocity.

q\mathbf{q}

Orientation.

mm

Mass.

p⃗\vec{p}

Momentum.

II

Moment of inertia.

qq

Charge.

NN

Number.

LL

Length.

VV

Volume.

PP

Pressure.

ρ\rho

Number density.

a⃗1\vec{a}_1, a⃗2\vec{a}_2, a⃗3\vec{a}_3

Box unit cell vectors.

F⃗\vec{F}

Force.

τ⃗\vec{\tau}

Torque.

UU

Potential energy.

KK

Kinetic energy.

EE

Total energy.

TT

Temperature.

kk

Boltzmann’s constant in some contexts. Typically appears multiplying temperature: kTkT.

kk

Spring constant in some contexts.

β\beta

1kT\frac{1}{kT}

tt

Time.