diff --git a/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_init b/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_init index 4a51825c..6ca5d274 100644 --- a/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_init +++ b/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_init @@ -43,16 +43,6 @@ fix zwalls2 all wall/gran model hertz tangential history primitive type 1 zp create_atoms 1 single 7.5 2.5 2.5 units box set atom 1 diameter 0.2 density 2267 vx 0 vy 0 vz 0 -# particle distributions and insertion -#region bc block 0.25 1.25 0. 0.5 0. 0.5 units box -#fix pts1 all particletemplate/sphere 1 atom_type 1 density constant 2267 radius constant 0.035 -#fix pdd1 all particledistribution/discrete 1 1 pts1 1.0 - -#fix ins all insert/pack seed 100001 distributiontemplate pdd1 vel constant 0. 0. 0. insert_every once overlapcheck yes all_in yes particles_in_region 1 region bc - -# apply nve integration to all particles that are inserted as single particles -#fix integr all nve/sphere - # screen output compute rke all erotate/sphere thermo_style custom step atoms ke c_rke vol diff --git a/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_run b/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_run index 155aff97..90b0e00e 100644 --- a/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_run +++ b/tutorials/cfdemSolverRhoPimpleChem/Shrinking_particle_model/DEM/in.liggghts_run @@ -19,7 +19,6 @@ reset_timestep 0 neighbor 0.0005 bin neigh_modify delay 0 binsize 0.01 - # Material properties required for granular pair styles fix m1 all property/global youngsModulus peratomtype 5.e6 @@ -32,7 +31,7 @@ pair_style gran model hertz tangential history # Hertzian without cohesion pair_coeff * * # timestep, gravity -timestep 0.000001 +timestep 1e-6 fix gravi all gravity 0.0 vector 0.0 -1.0 0.0 # walls @@ -53,7 +52,7 @@ fix cfd3 all couple/cfd/chemistry n_species 3 species_names O2 CO2 N2 # this should shrink the particle #fix cfd4 all chem/shrink speciesA O2 molMassA 31.99 speciesC CO2 molMassC 44.01 molMassB 12.01 k 2.5e3 rdef 0.2 -fix cfd4 all chem/shrink speciesA O2 molMassA 31.99 speciesC CO2 molMassC 44.01 molMassB 12.01 k 2.5e-1 rmin 0.005 nevery 1000 +fix cfd4 all chem/shrink speciesA O2 molMassA 31.99 speciesC CO2 molMassC 44.01 molMassB 12.01 k 2.5e-1 rmin 0.005 nevery 1 # apply nve integration to all particles that are inserted as single particles fix integr all nve/sphere