Dear lammpas user,
FIX TTM
The initial electronic temperature input file, T_infile, is a text file LAMMPS reads in with no header and with four numeric columns (ix,iy,iz,Temp)
0 0 0 1.0
0 0 1 1.0
0 0 2 1.0
0 1 0 2.0
0 1 1 2.0
0 1 2 2.0
can write as follow,in my input script file,I want to run at room temperature.
0 0 0 300.0
0 1 0 300.0
0 2 0 300.0
0 3 0 300.0
0 4 0 300.0
0 5 0 300.0
0 6 0 300.0
0 7 0 300.0
If at more than room temperature
0 0 0 1200.0
0 1 0 1100.0
0 2 0 1000.0
0 3 0 900.0
0 4 0 800.0
0 5 0 700.0
0 6 0 600.0
0 7 0 300.0
I want clear information about this