while space and source formatting cleanup

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Axel Kohlmeyer 2019-04-29 09:17:29 -04:00
parent 6088f2a6a2
commit af8a71b1ad
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6 changed files with 41 additions and 41 deletions

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@ -17,13 +17,13 @@ wall/gran = style name of this fix command :l
fstyle = style of force interactions between particles and wall :l fstyle = style of force interactions between particles and wall :l
possible choices: hooke, hooke/history, hertz/history, granular :pre possible choices: hooke, hooke/history, hertz/history, granular :pre
fstyle_params = parameters associated with force interaction style :l fstyle_params = parameters associated with force interaction style :l
For {hooke}, {hooke/history}, and {hertz/history}, {fstyle_params} are: For {hooke}, {hooke/history}, and {hertz/history}, {fstyle_params} are:
Kn = elastic constant for normal particle repulsion (force/distance units or pressure units - see discussion below) Kn = elastic constant for normal particle repulsion (force/distance units or pressure units - see discussion below)
Kt = elastic constant for tangential contact (force/distance units or pressure units - see discussion below) Kt = elastic constant for tangential contact (force/distance units or pressure units - see discussion below)
gamma_n = damping coefficient for collisions in normal direction (1/time units or 1/time-distance units - see discussion below) gamma_n = damping coefficient for collisions in normal direction (1/time units or 1/time-distance units - see discussion below)
gamma_t = damping coefficient for collisions in tangential direction (1/time units or 1/time-distance units - see discussion below) gamma_t = damping coefficient for collisions in tangential direction (1/time units or 1/time-distance units - see discussion below)
xmu = static yield criterion (unitless value between 0.0 and 1.0e4) xmu = static yield criterion (unitless value between 0.0 and 1.0e4)
dampflag = 0 or 1 if tangential damping force is excluded or included :pre dampflag = 0 or 1 if tangential damping force is excluded or included :pre
For {granular}, {fstyle_params} are set using the same syntax as for the {pair_coeff} command of "pair_style granular"_pair_granular.html :pre For {granular}, {fstyle_params} are set using the same syntax as for the {pair_coeff} command of "pair_style granular"_pair_granular.html :pre
wallstyle = {xplane} or {yplane} or {zplane} or {zcylinder} :l wallstyle = {xplane} or {yplane} or {zplane} or {zcylinder} :l
args = list of arguments for a particular style :l args = list of arguments for a particular style :l

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@ -17,20 +17,20 @@ wall/region = style name of this fix command :l
fstyle = style of force interactions between particles and wall :l fstyle = style of force interactions between particles and wall :l
possible choices: hooke, hooke/history, hertz/history, granular :pre possible choices: hooke, hooke/history, hertz/history, granular :pre
fstyle_params = parameters associated with force interaction style :l fstyle_params = parameters associated with force interaction style :l
For {hooke}, {hooke/history}, and {hertz/history}, {fstyle_params} are: For {hooke}, {hooke/history}, and {hertz/history}, {fstyle_params} are:
Kn = elastic constant for normal particle repulsion (force/distance units or pressure units - see discussion below) Kn = elastic constant for normal particle repulsion (force/distance units or pressure units - see discussion below)
Kt = elastic constant for tangential contact (force/distance units or pressure units - see discussion below) Kt = elastic constant for tangential contact (force/distance units or pressure units - see discussion below)
gamma_n = damping coefficient for collisions in normal direction (1/time units or 1/time-distance units - see discussion below) gamma_n = damping coefficient for collisions in normal direction (1/time units or 1/time-distance units - see discussion below)
gamma_t = damping coefficient for collisions in tangential direction (1/time units or 1/time-distance units - see discussion below) gamma_t = damping coefficient for collisions in tangential direction (1/time units or 1/time-distance units - see discussion below)
xmu = static yield criterion (unitless value between 0.0 and 1.0e4) xmu = static yield criterion (unitless value between 0.0 and 1.0e4)
dampflag = 0 or 1 if tangential damping force is excluded or included :pre dampflag = 0 or 1 if tangential damping force is excluded or included :pre
For {granular}, {fstyle_params} are set using the same syntax as for the {pair_coeff} command of "pair_style granular"_pair_granular.html :pre For {granular}, {fstyle_params} are set using the same syntax as for the {pair_coeff} command of "pair_style granular"_pair_granular.html :pre
wallstyle = region (see "fix wall/gran"_fix_wall_gran.html for options for other kinds of walls) :l wallstyle = region (see "fix wall/gran"_fix_wall_gran.html for options for other kinds of walls) :l
region-ID = region whose boundary will act as wall :l,ule region-ID = region whose boundary will act as wall :l,ule
[Examples:] [Examples:]
fix wall all wall/gran/region hooke/history 1000.0 200.0 200.0 100.0 0.5 1 region myCone fix wall all wall/gran/region hooke/history 1000.0 200.0 200.0 100.0 0.5 1 region myCone
fix 3 all wall/gran/region granular hooke 1000.0 50.0 tangential linear_nohistory 1.0 0.4 damping velocity region myBox fix 3 all wall/gran/region granular hooke 1000.0 50.0 tangential linear_nohistory 1.0 0.4 damping velocity region myBox
fix 4 all wall/gran/region granular jkr 1e5 1500.0 0.3 10.0 tangential mindlin NULL 1.0 0.5 rolling sds 500.0 200.0 0.5 twisting marshall region myCone fix 4 all wall/gran/region granular jkr 1e5 1500.0 0.3 10.0 tangential mindlin NULL 1.0 0.5 rolling sds 500.0 200.0 0.5 twisting marshall region myCone
fix 5 all wall/gran/region granular dmt 1e5 0.2 0.3 10.0 tangential mindlin NULL 1.0 0.5 rolling sds 500.0 200.0 0.5 twisting marshall damping tsuji region myCone :pre fix 5 all wall/gran/region granular dmt 1e5 0.2 0.3 10.0 tangential mindlin NULL 1.0 0.5 rolling sds 500.0 200.0 0.5 twisting marshall damping tsuji region myCone :pre

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@ -66,8 +66,8 @@ mixed coefficients for type 1 - type 2 interactions can be determined from
mixing rules discussed below. For additional flexibility, mixing rules discussed below. For additional flexibility,
coefficients as well as model forms can vary between particle types, coefficients as well as model forms can vary between particle types,
as shown in the fourth example: type 1 - type 1 interactions are based as shown in the fourth example: type 1 - type 1 interactions are based
on a Johnson-Kendall-Roberts normal contact model and 2-2 interactions on a Johnson-Kendall-Roberts normal contact model and 2-2 interactions
are based on a DMT cohesive model (see below). In that example, 1-1 are based on a DMT cohesive model (see below). In that example, 1-1
and 2-2 interactions have different model forms, in which case mixing of and 2-2 interactions have different model forms, in which case mixing of
coefficients cannot be determined, so 1-2 interactions must be coefficients cannot be determined, so 1-2 interactions must be
explicitly defined via the {pair_coeff 1 *} command, otherwise an explicitly defined via the {pair_coeff 1 *} command, otherwise an
@ -215,9 +215,9 @@ For {damping mass_velocity}, the normal damping is given by:
\end\{equation\} \end\{equation\}
Here, \(\eta_\{n0\}\) is the damping coefficient specified for the normal Here, \(\eta_\{n0\}\) is the damping coefficient specified for the normal
contact model, in units of {mass}/{time} and contact model, in units of {mass}/{time} and
\(m_\{eff\} = m_i m_j/(m_i + m_j)\) is the effective mass. \(m_\{eff\} = m_i m_j/(m_i + m_j)\) is the effective mass.
Use {damping mass_velocity} to reproduce the damping behavior of Use {damping mass_velocity} to reproduce the damping behavior of
{pair gran/hooke/*}. {pair gran/hooke/*}.
The {damping viscoelastic} model is based on the viscoelastic The {damping viscoelastic} model is based on the viscoelastic
@ -228,9 +228,9 @@ damping is given by:
\eta_n = \eta_\{n0\}\ a m_\{eff\} \eta_n = \eta_\{n0\}\ a m_\{eff\}
\end\{equation\} \end\{equation\}
Here, {a} is the contact radius, given by \(a =\sqrt\{R\delta\}\) Here, {a} is the contact radius, given by \(a =\sqrt\{R\delta\}\)
for all models except {jkr}, for which it is given implicitly according for all models except {jkr}, for which it is given implicitly according
to \(\delta = a^2/R - 2\sqrt\{\pi \gamma a/E\}\). For {damping viscoelastic}, to \(\delta = a^2/R - 2\sqrt\{\pi \gamma a/E\}\). For {damping viscoelastic},
\(\eta_\{n0\}\) is in units of 1/({time}*{distance}). \(\eta_\{n0\}\) is in units of 1/({time}*{distance}).
The {tsuji} model is based on the work of "(Tsuji et The {tsuji} model is based on the work of "(Tsuji et
@ -583,11 +583,11 @@ The {granular} pair style can reproduce the behavior of the
minor differences can be expected due to corrections in minor differences can be expected due to corrections in
displacement history frame-of-reference, and the application displacement history frame-of-reference, and the application
of the torque at the center of the contact rather than of the torque at the center of the contact rather than
at each particle). The first example above at each particle). The first example above
is equivalent to {pair gran/hooke 1000.0 NULL 50.0 50.0 0.4 1}. is equivalent to {pair gran/hooke 1000.0 NULL 50.0 50.0 0.4 1}.
The second example is equivalent to The second example is equivalent to
{pair gran/hooke/history 1000.0 500.0 50.0 50.0 0.4 1}. {pair gran/hooke/history 1000.0 500.0 50.0 50.0 0.4 1}.
The third example is equivalent to The third example is equivalent to
{pair gran/hertz/history 1000.0 500.0 50.0 50.0 0.4 1}. {pair gran/hertz/history 1000.0 500.0 50.0 50.0 0.4 1}.
:line :line
@ -734,7 +734,7 @@ For the {pair_coeff} settings: {damping viscoelastic}, {rolling none},
J. M., & Poschel, T. (1996). Model for collisions in granular J. M., & Poschel, T. (1996). Model for collisions in granular
gases. Physical review E, 53(5), 5382. gases. Physical review E, 53(5), 5382.
:link(Tsuji1992) :link(Tsuji1992)
[(Tsuji et al, 1992)] Tsuji, Y., Tanaka, T., & Ishida, [(Tsuji et al, 1992)] Tsuji, Y., Tanaka, T., & Ishida,
T. (1992). Lagrangian numerical simulation of plug flow of T. (1992). Lagrangian numerical simulation of plug flow of
cohesionless particles in a horizontal pipe. Powder technology, 71(3), cohesionless particles in a horizontal pipe. Powder technology, 71(3),

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@ -1161,7 +1161,7 @@ void FixWallGran::granular(double rsq, double dx, double dy, double dz,
if (damping_model == VELOCITY) { if (damping_model == VELOCITY) {
damp_normal = 1; damp_normal = 1;
} }
else if (damping_model == MASS_VELOCITY){ else if (damping_model == MASS_VELOCITY) {
damp_normal = meff; damp_normal = meff;
} }
else if (damping_model == VISCOELASTIC) { else if (damping_model == VISCOELASTIC) {

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@ -121,7 +121,7 @@ void FixWallGranRegion::init()
region->reset_vel(); region->reset_vel();
} }
if (motion_resetflag){ if (motion_resetflag) {
char str[256]; char str[256];
snprintf(str,256,"Region properties for region %s are inconsistent " snprintf(str,256,"Region properties for region %s are inconsistent "
"with restart file, resetting its motion",idregion); "with restart file, resetting its motion",idregion);
@ -190,7 +190,7 @@ void FixWallGranRegion::post_force(int /*vflag*/)
if (mask[i] & groupbit) { if (mask[i] & groupbit) {
if (!region->match(x[i][0],x[i][1],x[i][2])) continue; if (!region->match(x[i][0],x[i][1],x[i][2])) continue;
if (pairstyle == GRANULAR && normal_model == JKR){ if (pairstyle == GRANULAR && normal_model == JKR) {
nc = region->surface(x[i][0],x[i][1],x[i][2], nc = region->surface(x[i][0],x[i][1],x[i][2],
radius[i]+pulloff_distance(radius[i])); radius[i]+pulloff_distance(radius[i]));
} }
@ -232,8 +232,8 @@ void FixWallGranRegion::post_force(int /*vflag*/)
rsq = region->contact[ic].r*region->contact[ic].r; rsq = region->contact[ic].r*region->contact[ic].r;
if (pairstyle == GRANULAR && normal_model == JKR){ if (pairstyle == GRANULAR && normal_model == JKR) {
if (history_many[i][c2r[ic]][0] == 0.0 && rsq > radius[i]*radius[i]){ if (history_many[i][c2r[ic]][0] == 0.0 && rsq > radius[i]*radius[i]) {
for (m = 0; m < size_history; m++) for (m = 0; m < size_history; m++)
history_many[i][0][m] = 0.0; history_many[i][0][m] = 0.0;
continue; continue;
@ -253,7 +253,7 @@ void FixWallGranRegion::post_force(int /*vflag*/)
if (fix_rigid && mass_rigid[i] > 0.0) meff = mass_rigid[i]; if (fix_rigid && mass_rigid[i] > 0.0) meff = mass_rigid[i];
// store contact info // store contact info
if (peratom_flag){ if (peratom_flag) {
array_atom[i][0] = (double)atom->tag[i]; array_atom[i][0] = (double)atom->tag[i];
array_atom[i][4] = x[i][0] - dx; array_atom[i][4] = x[i][0] - dx;
array_atom[i][5] = x[i][1] - dy; array_atom[i][5] = x[i][1] - dy;
@ -382,7 +382,7 @@ void FixWallGranRegion::copy_arrays(int i, int j, int /*delflag*/)
{ {
int m,n,iwall; int m,n,iwall;
if (use_history){ if (use_history) {
n = ncontact[i]; n = ncontact[i];
for (iwall = 0; iwall < n; iwall++) { for (iwall = 0; iwall < n; iwall++) {
walls[j][iwall] = walls[i][iwall]; walls[j][iwall] = walls[i][iwall];
@ -392,7 +392,7 @@ void FixWallGranRegion::copy_arrays(int i, int j, int /*delflag*/)
ncontact[j] = ncontact[i]; ncontact[j] = ncontact[i];
} }
if (peratom_flag){ if (peratom_flag) {
for (int m = 0; m < size_peratom_cols; m++) for (int m = 0; m < size_peratom_cols; m++)
array_atom[j][m] = array_atom[i][m]; array_atom[j][m] = array_atom[i][m];
} }
@ -406,7 +406,7 @@ void FixWallGranRegion::set_arrays(int i)
{ {
if (use_history) if (use_history)
ncontact[i] = 0; ncontact[i] = 0;
if (peratom_flag){ if (peratom_flag) {
for (int m = 0; m < size_peratom_cols; m++) for (int m = 0; m < size_peratom_cols; m++)
array_atom[i][m] = 0; array_atom[i][m] = 0;
} }
@ -421,7 +421,7 @@ int FixWallGranRegion::pack_exchange(int i, double *buf)
int m; int m;
int n = 0; int n = 0;
if (use_history){ if (use_history) {
int count = ncontact[i]; int count = ncontact[i];
buf[n++] = ubuf(count).d; buf[n++] = ubuf(count).d;
for (int iwall = 0; iwall < count; iwall++) { for (int iwall = 0; iwall < count; iwall++) {
@ -430,7 +430,7 @@ int FixWallGranRegion::pack_exchange(int i, double *buf)
buf[n++] = history_many[i][iwall][m]; buf[n++] = history_many[i][iwall][m];
} }
} }
if (peratom_flag){ if (peratom_flag) {
for (int m = 0; m < size_peratom_cols; m++) for (int m = 0; m < size_peratom_cols; m++)
buf[n++] = array_atom[i][m]; buf[n++] = array_atom[i][m];
} }
@ -448,7 +448,7 @@ int FixWallGranRegion::unpack_exchange(int nlocal, double *buf)
int n = 0; int n = 0;
if (use_history){ if (use_history) {
int count = ncontact[nlocal] = (int) ubuf(buf[n++]).i; int count = ncontact[nlocal] = (int) ubuf(buf[n++]).i;
for (int iwall = 0; iwall < count; iwall++) { for (int iwall = 0; iwall < count; iwall++) {
walls[nlocal][iwall] = (int) ubuf(buf[n++]).i; walls[nlocal][iwall] = (int) ubuf(buf[n++]).i;
@ -456,7 +456,7 @@ int FixWallGranRegion::unpack_exchange(int nlocal, double *buf)
history_many[nlocal][iwall][m] = buf[n++]; history_many[nlocal][iwall][m] = buf[n++];
} }
} }
if (peratom_flag){ if (peratom_flag) {
for (int m = 0; m < size_peratom_cols; m++) for (int m = 0; m < size_peratom_cols; m++)
array_atom[nlocal][m] = buf[n++]; array_atom[nlocal][m] = buf[n++];
} }

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@ -418,7 +418,7 @@ void PairGranular::compute(int eflag, int vflag)
} }
// rotate and update displacements. // rotate and update displacements.
// see e.g. eq. 17 of Luding, Gran. Matter 2008, v10,p235 // see e.g. eq. 17 of Luding, Gran. Matter 2008, v10,p235
if (historyupdate){ if (historyupdate) {
rsht = history[0]*nx + history[1]*ny + history[2]*nz; rsht = history[0]*nx + history[1]*ny + history[2]*nz;
if (fabs(rsht) < EPSILON) rsht = 0; if (fabs(rsht) < EPSILON) rsht = 0;
if (rsht > 0) { if (rsht > 0) {
@ -958,7 +958,7 @@ void PairGranular::coeff(int narg, char **arg)
} }
/* ---------------------------------------------------------------------- /* ----------------------------------------------------------------------
init specific to this pair style init specific to this pair style
------------------------------------------------------------------------- */ ------------------------------------------------------------------------- */
void PairGranular::init_style() void PairGranular::init_style()