#------------------------------------------------------------------------------- # Stage 2.6: Custom code #------------------------------------------------------------------------------- thermo_style custom step v_time press vol v_sysdensity temp ebond eangle edihed eimp evdwl ecoul etail elong pe ke thermo 100 fix 1 movable nvt temp 298.2 298.2 100 drag 0.0 compute myADF1 subset_jiemian adf 200 6 7 7 0 3.3 0 3.3 fix ad1 subset_jiemian ave/time 1 0 0 c_myADF1[*] file tmp1.adf mode vector ERROR: Illegal fix ave/time command (../fix_ave_time.cpp:126) Last command: fix ad1 subset_jiemian ave/time 1 0 0 c_myADF1[*] file tmp1.adf mode vector