"LAMMPS WWW Site"_lws - "LAMMPS Documentation"_ld - "LAMMPS Commands"_lc :c

:link(lws,http://lammps.sandia.gov)
:link(ld,Manual.html)
:link(lc,Section_commands.html#comm)

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compute tdpd/cc/atom command :h3

[Syntax:]

compute ID group-ID tdpd/cc/atom index :pre

ID, group-ID are documented in "compute"_compute.html command
tdpd/cc/atom = style name of this compute command 
index = index of chemical species (1 to Nspecies) :ul

[Examples:]

compute 1 all tdpd/cc/atom 2 :pre

[Description:]

Define a computation that calculates the per-atom chemical
concentration of a specified species for each tDPD particle in a
group.

The chemical concentration of each species is defined as the number of
molecules carried by a tDPD particle for dilute solution.  For more
details see "(Li2015)"_#Li2015a.

[Output info:]

This compute calculates a per-atom vector, which can be accessed by
any command that uses per-atom values from a compute as input. See
"Section 6.15"_Section_howto.html#howto_15 for an overview of
LAMMPS output options.

The per-atom vector values will be in the units of chemical species 
per unit mass.

[Restrictions:]

This compute is part of the USER-MESO package.  It is only enabled if
LAMMPS was built with that package.  See the "Making
LAMMPS"_Section_start.html#start_3 section for more info.

[Related commands:]

"pair_style tdpd"_pair_meso.html

[Default:] none

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:link(Li2015a)
[(Li2015)] Li, Yazdani, Tartakovsky, Karniadakis, J Chem Phys, 143:
014101 (2015).  DOI: 10.1063/1.4923254

