change name zhou to momb in docs, fix grammar

This commit is contained in:
Tonnam Balankura
2017-03-23 10:08:47 -04:00
parent bf560e78f3
commit 6d395ec511
5 changed files with 13 additions and 13 deletions

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@ -1035,6 +1035,7 @@ package"_Section_start.html#start_3.
"meam/spline (o)"_pair_meam_spline.html,
"meam/sw/spline"_pair_meam_sw_spline.html,
"mgpt"_pair_mgpt.html,
"momb"_pair_momb.html,
"morse/smooth/linear"_pair_morse.html,
"morse/soft"_pair_morse.html,
"multi/lucy"_pair_multi_lucy.html,
@ -1061,8 +1062,7 @@ package"_Section_start.html#start_3.
"table/rx"_pair_table_rx.html,
"tersoff/table (o)"_pair_tersoff.html,
"thole"_pair_thole.html,
"tip4p/long/soft (o)"_pair_lj_soft.html,
"zhou"_pair_zhou.html :tb(c=4,ea=c)
"tip4p/long/soft (o)"_pair_lj_soft.html :tb(c=4,ea=c)
:line

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@ -6,11 +6,11 @@
:line
pair_style zhou command :h3
pair_style momb command :h3
[Syntax:]
pair_style zhou cutoff s6 d :pre
pair_style momb cutoff s6 d :pre
cutoff = global cutoff (distance units)
s6 = global scaling factor of the exchange-correlation functional used (unitless)
@ -18,22 +18,22 @@ d = damping scaling factor of Grimme's method (unitless) :ul
[Examples:]
pair_style zhou 12.0 0.75 20.0
pair_style hybrid/overlay eam/fs lj/charmm/coul/long 10.0 12.0 zhou 12.0 0.75 20.0 morse 5.5 :pre
pair_style momb 12.0 0.75 20.0
pair_style hybrid/overlay eam/fs lj/charmm/coul/long 10.0 12.0 momb 12.0 0.75 20.0 morse 5.5 :pre
pair_coeff 1 2 zhou 0.0 1.0 1.0 10.2847 2.361 :pre
pair_coeff 1 2 momb 0.0 1.0 1.0 10.2847 2.361 :pre
[Description:]
Style {zhou} computes pairwise van der Waals (vdW) and short-range interactions using the
Style {momb} computes pairwise van der Waals (vdW) and short-range interactions using the
Morse potential and "(Grimme)"_#Grimme method implemented in the Many-Body
Metal-Organic (MOMB) force field described comprehensively in "(Fichthorn)"_#Fichthorn and
"(Zhou)"_#Zhou4. The Grimme's method is widely used to correct for dispersion
"(Zhou)"_#Zhou4. Grimme's method is widely used to correct for dispersion
in density functional theory calculations.
:c,image(Eqs/pair_zhou.jpg)
:c,image(Eqs/pair_momb.jpg)
For the {zhou} pair style, the following coefficients must be defined for each
For the {momb} pair style, the following coefficients must be defined for each
pair of atoms types via the "pair_coeff"_pair_coeff.html command as in the
examples above, or in the data file or restart files read by the
"read_data"_read_data.html as described below:
@ -49,7 +49,7 @@ Rr (distance units, typically sum of atomic vdW radii) :ul
[Restrictions:]
This style is part of the USER-MISC package. It is only enabled if
LAMMPS is build with that package. See the "Making of
LAMMPS is built with that package. See the "Making of
LAMMPS"_Section_start.html#start_3 section for more info.
[Related commands:]

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@ -60,6 +60,7 @@ Pair Styles :h1
pair_meam_sw_spline
pair_mgpt
pair_mie
pair_momb
pair_morse
pair_multi_lucy
pair_multi_lucy_rx
@ -101,6 +102,5 @@ Pair Styles :h1
pair_yukawa_colloid
pair_zbl
pair_zero
pair_zhou
END_RST -->