INITIAL SLAB CONFIGURATIONS FOR HCl + Au(111) 
             NORMAL INCIDENCE                  
 Z_START 7.5 Angstrom 
 ZSHIFT  0 Angstrom 
 SEED NUMBER   431001
 SEED NUMBER 2 10234789
 NUMBER OF POSCARS CREATED 10
 BEAM IS SWITCHED ON; Trot .neq. (Tvib == Tnozzle) 
  Tnozzle : 1060 K 
 Tvib    : 1060 K 
 Trot    : 505.814 K 
 Estream : 2.47 eV
 vstream : 3615.84 m/s 
 width a : 371 m/s 
AVERAGE KINETIC ENERGY IN Z : 2.47077 eV
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EXPECTATION RO-VIBR. ENERGY VALUE 
ANALYTICAL VALUE: 228.989 meV 
NUMERICAL  VALUE: 226.203 meV