# pour two types of particles (cohesive and non-cohesive) into cylinder

# 'turn' cylinder by changing direction of gravity, then rotate it.

# This simulates a rotating drum powder characterization experiment.

variable name string rotating_drum_two_types

atom_style sphere
units lj

###############################################
# Geometry-related parameters
###############################################

variable boxx equal 30

variable boxy equal 30
variable boxz equal 50

variable drum_rad equal ${boxx}*0.5

variable drum_height equal 20

variable xc equal 0.5*${boxx}

variable yc equal 0.5*${boxx}
variable zc equal 0.5*${boxz}

###############################################
# Particle-related parameters
###############################################
variable rlo equal 0.25
variable rhi equal 0.5
variable dlo equal 2.0*${rlo}
variable dhi equal 2.0*${rhi}

variable cyl_rad_inner equal ${drum_rad}-1.1*${rhi}

variable dens equal 1.0

variable skin equal 0.4*${rhi}

#############
processors * * 1
region boxreg block 0 ${boxx} 0 ${boxy} 0 ${boxz}
create_box 2 boxreg
change_box all boundary p p f
comm_modify vel yes

variable theta equal 0

region curved_wall cylinder z ${xc} ${yc} ${drum_rad} 0 ${drum_height}

side in rotate v_theta ${xc} ${yc} 0 0 0 1
region bottom_wall plane ${xc} ${yc} 0 0 0 1 side in rotate v_theta $
{xc} ${yc} 0 0 0 1

region insreg cylinder z ${xc} ${yc} ${cyl_rad_inner} ${drum_height} $

{boxz}

fix 0 all balance 100 1.0 shift xy 5 1.1

fix 1 all nve/sphere
fix grav all gravity 10 vector 0 0 -1
fix ins1 all pour 2000 1 1234 region insreg diam range ${dlo} ${dhi} dens $
{dens} ${dens}
fix ins2 all pour 2000 2 1234 region insreg diam range ${dlo} ${dhi} dens $
{dens} ${dens}

comm_modify vel yes

neighbor ${skin} bin

neigh_modify delay 0 every 1 check yes

pair_style granular
pair_coeff 1 * hertz/material 1e5 0.2 0.3 tangential mindlin NULL 1.0 0.5 damping
tsuji
pair_coeff 2 2 jkr 1e5 0.1 0.3 50 tangential mindlin NULL 1.0 0.5 rolling sds 1e3
1e3 0.1 twisting marshall damping tsuji

fix 3 all wall/gran/region granular hertz/material 1e5 0.1 0.3 tangential

mindlin NULL 1.0 0.5 damping tsuji region curved_wall
fix 4 all wall/gran/region granular hertz/material 1e5 0.1 0.3 tangential
mindlin NULL 1.0 0.5 damping tsuji region bottom_wall

thermo_style custom step atoms ke v_theta

thermo_modify lost warn
thermo 100

timestep 0.001

#dump 1 all custom 100 ${name}.dump id type radius mass x y z

#For removal later

compute 1 all property/atom radius
variable zmax atom z+c_1>0.5*${drum_height}
group delgroup dynamic all var zmax every 10000

run 2000

#Remove any particles that are above z > 0.5*drum_height

delete_atoms group delgroup

#Add top lid

region top_wall plane ${xc} ${yc} ${drum_height} 0 0 -1 side in rotate
v_theta ${xc} ${yc} 0 0 0 1
fix 5 all wall/gran/region granular hertz/material 1e5 0.1 0.3 tangential
mindlin NULL 1.0 0.5 damping tsuji region top_wall

# 'Turn' drum by switching the direction of gravity

unfix grav
fix grav all gravity 10 vector 0 -1 0

variable theta equal 2*PI*elapsed/20000.0

run 3000