Added:

- For Paramag. simulations, the option "atom_modify" has to be set
ex: atom_modify sort 1000 4.0 (Freq,Dist).
- Actual time is now printed (c_mag[0] in compute_spin)
- Value of Gilbert's damping corrected
- Now even results for SD/Lammps comp. in purely paramg. or aniso. situations
- Pack and unpack reverse needed corrections (f only was set, not fm)
- Spin temperature is now computed (data c_mag[7] in spin_compute)

To do:
- Fcc with p p p bc is still not working
- If Zeeman/Aniso force not defined, error => to be removed
- Add DMI and ME (see if new file or add in the exchange file)

src/set.cpp

@@ -860,7 +860,7 @@ void Set::set(int keyword)
       sp[i][2] = zvalue/sp_norm;
       sp[i][3] = sqrt(sp[i][0]*sp[i][0] + sp[i][1]*sp[i][1] +
                       sp[i][2]*sp[i][2]); //Should be 1 for atomic spins
-      mumag[i] = sp_norm;
+      mumag[i] = dvalue;
     }
 
     // set quaternion orientation of ellipsoid or tri or body particle