Pedram Tavazohi edited section_Single_Run_Inorder_to__.tex  almost 8 years ago

Commit id: 2b956a4b939cee576b6c20dd05583f54ee597cef

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\section{Single Run}  Inorder to make FIREBALL to run a MDET simulation, one has to have the flag "imdet = 1" in the fireball.in. The following is the fireball.in used for azobenzene molecule.  \subsection{fireball.in}  =====================================  &option =====================================\\  &option\\  basisfile=input.bas \n  iensemble = 3\n  iquench = 0\n