Greetings,
I need help please with this error
WARNING: No fixes with time integration, atoms won’t move (src/verlet.cpp:60)
ERROR: All pair coeffs are not set (src/pair.cpp:249)
Last command: rerun traj_npt.lammpstrj dump x y z vx vy vz ix iy iz box yes
read_restart “restart.9900000.npt”
#reset_timestep 0
#kspace_style pppm 0.0001
#group spce type 10:11
#fix fShakeSPCE spce shake 0.0001 10 100 b 8 a 14
restart 10000000 restart.2process.*
rerun traj_npt.lammpstrj dump x y z vx vy vz ix iy iz box yes
variables
variable nNPT equal 10000000
variable T equal 300
variable Nfreq equal 1000
#calculations
compute gyr all gyration
variable rg equal c_gyr
fix 1 all ave/time 10000 1 10000000 v_rg file rg.dat
compute Rg pnipam gyration
compute RDF_ON all rdf 50 7 10 7 11 8 10 8 11
fix rdf_on all ave/time 1 {Nfreq} {Nfreq} c_RDF_ON[*] file rdf_ON.log mode vector
compute RDF_OH all rdf 50 10 5 10 9
fix rdf_n all ave/time 100000 {Nfreq} {Nfreq} c_RDF_OH[*] file rdf_OH.log mode vector
shell mkdir ./images_3output
dump 1 all xyz 10000 ./images_3process/.xyz
dump_modify 1 element C C C C H C O N H O H
log log.3Output
thermo 10
thermo_style custom step temp pe press c_Rg # c_Coor_n[]
info coeffs
write_coeff pinpam.coeff
run ${nNPT}