Update doc/src/compute_count_type.rst

Co-authored-by: Axel Kohlmeyer <akohlmey@gmail.com>
This commit is contained in:
Jacob Gissinger
2024-04-23 23:32:27 -04:00
committed by GitHub
parent f6eeaaef6f
commit b2aed19c88

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@ -80,7 +80,7 @@ atoms like so:
compute typevec all count/type atom # number of atoms of each type
variable normtypes vector c_typevec/atoms # divide by total number of atoms
variable ntypes equal extract_setting(ntypes) # number of atom types
thermo_style custom step v_normtypes[*$(v_ntypes)] # vector variable needs upper limit
thermo_style custom step v_normtypes[*${ntypes}] # vector variable needs upper limit
Similarly, bond counts can be normalized by the total number of bonds.
The same goes for angles, dihedrals, and impropers (see below).