@SET BASE_NAME md
@SET ID 01
&GLOBAL
  PRINT_LEVEL LOW
  PROJECT md-01
  RUN_TYPE MD
&END GLOBAL

@SET DFT BLYP
@SET EPS_SCF 5.0E-7
@SET SCF_GUESS ATOMIC
@SET METHOD Quickstep
@SET WAN F
@SET PATH_BASIS GTH_BASIS_SETS
@SET PATH_POTENTIAL POTENTIAL
@INCLUDE 2h2o_md_qs_forceeval.inc
@SET ENSEMBLE NVE
@SET STEPS 4
@SET TIMESTEP 0.25
@INCLUDE 2h2o_md_qs_motion.inc