use temp instead of temp_list[ii] in _gen_lammps_input to avoid error for p path

Author: Yi-FanLi

dpti/mti.py

@@ -232,7 +232,7 @@ def make_tasks(iter_name, jdata):
                             nsteps,
                             timestep,
                             ens,
-                            temp_list[ii],
+                            temp=temp,
                             pres=pres,
                             tau_t=tau_t,
                             thermo_freq=thermo_freq,
@@ -250,7 +250,7 @@ def make_tasks(iter_name, jdata):
                             nsteps,
                             timestep,
                             ens,
-                            temp_list[ii],
+                            temp=temp,
                             pres=pres,
                             tau_t=tau_t,
                             thermo_freq=thermo_freq,
@@ -285,7 +285,7 @@ def make_tasks(iter_name, jdata):
                         nsteps,
                         timestep,
                         ens,
-                        temp_list[ii],
+                        temp=temp,
                         pres=pres,
                         tau_t=tau_t,
                         thermo_freq=thermo_freq,
@@ -303,7 +303,7 @@ def make_tasks(iter_name, jdata):
                         nsteps,
                         timestep,
                         ens,
-                        temp_list[ii],
+                        temp=temp,
                         pres=pres,
                         tau_t=tau_t,
                         thermo_freq=thermo_freq,