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still to early for CSVR thermostat ;-)

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svn-origin-rev: 6370
This commit is contained in:
Teodoro Laino 2007-09-26 12:45:49 +00:00
parent 29ee307082
commit bc3ca864db
1 changed files with 3 additions and 0 deletions
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3
src/md.F
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@ -435,6 +435,9 @@ CPSourceFileRef,&
CALL section_vals_val_get(tmp_section,"TIMECON",r_val=simpar%tau_nhc,error=error)
CALL section_vals_val_get(tmp_section,"MTS",i_val=simpar%nc,error=error)
CASE (do_thermo_csvr)
CALL cp_unimplemented_error(fromWhere=routineP, &
message="CSVR thermostat not implemented yet!", &
error=error, error_level=cp_fatal_level)
! Canonical Sampling through velocity rescaling
tmp_section => section_vals_get_subs_vals(thermostat_section,"CSVR",error=error)
CALL section_vals_val_get(tmp_section,"TIMECON",r_val=simpar%tau_nhc,error=error)