General commands

Fix styles

Compute styles

Pair styles

Bond styles

Angle styles

Dihedral styles

Improper styles

KSpace styles

5.7. Compute commands

An alphabetic list of all LAMMPS compute commands. Some styles have accelerated versions. This is indicated by additional letters in parenthesis: g = GPU, i = USER-INTEL, k = KOKKOS, o = USER-OMP, t = OPT.

ackland/atom

adf

aggregate/atom

angle

angle/local

angmom/chunk

basal/atom

body/local

bond

bond/local

centro/atom

chunk/atom

chunk/spread/atom

cluster/atom

cna/atom

cnp/atom

com

com/chunk

contact/atom

coord/atom

damage/atom

dihedral

dihedral/local

dilatation/atom

dipole/chunk

displace/atom

dpd

dpd/atom

edpd/temp/atom

entropy/atom

erotate/asphere

erotate/rigid

erotate/sphere

erotate/sphere/atom

event/displace

fep

force/tally

fragment/atom

global/atom

group/group

gyration

gyration/chunk

gyration/shape

heat/flux

heat/flux/tally

hexorder/atom

improper

improper/local

inertia/chunk

ke

ke/atom

ke/atom/eff

ke/eff

ke/rigid

meso/e/atom

meso/rho/atom

meso/t/atom

momentum

msd

msd/chunk

msd/nongauss

omega/chunk

orientorder/atom

pair

pair/local

pe

pe/atom

pe/mol/tally

pe/tally

plasticity/atom

pressure

pressure/cylinder

pressure/uef

property/atom

property/chunk

property/local

ptm/atom

rdf

reduce

reduce/chunk

reduce/region

rigid/local

saed

slice

smd/contact/radius

smd/damage

smd/hourglass/error

smd/internal/energy

smd/plastic/strain

smd/plastic/strain/rate

smd/rho

smd/tlsph/defgrad

smd/tlsph/dt

smd/tlsph/num/neighs

smd/tlsph/shape

smd/tlsph/strain

smd/tlsph/strain/rate

smd/tlsph/stress

smd/triangle/vertices

smd/ulsph/num/neighs

smd/ulsph/strain

smd/ulsph/strain/rate

smd/ulsph/stress

smd/vol

sna/atom

snad/atom

snav/atom

spin

stress/atom

stress/mop

stress/mop/profile

stress/tally

tdpd/cc/atom

temp (k)

temp/asphere

temp/body

temp/chunk

temp/com

temp/cs

temp/deform

temp/deform/eff

temp/drude

temp/eff

temp/partial

temp/profile

temp/ramp

temp/region

temp/region/eff

temp/rotate

temp/sphere

temp/uef

ti

torque/chunk

vacf

vcm/chunk

voronoi/atom

xrd