To relax 0. a provided defect 1. a user-defined configuration: 0 Name of the defect configuration (->*): perfect_crystal User defined configuration file that could be read in (default=*): default Pair potential to be used (LJ6_12 or WOON): WOON const_H or const_s mode: const_s Number of atoms in corresponding perfect crystal(fcc) state: 500 Default supercell (11,22,33,12,13,23), in Angstrom: 26.4 26.4 26.4 0. 0. 0. In const_s mode, should the above be enforced initially (yes/no)? Yes Default external stress (11,22,33,12,13,23), in MPa: 0. 0. 0. 0. 0. 0. Index of the provided defect that could be relaxed: (0. perfect_crystal 1. vacancy 2. interstitial) 0 Amplitude of random position perturbations (in lattice constant): 0.01 Random number generator seed (long integer): 453215321 Minimization tolerance: 0.000000001 Save to .xyz files the position of atoms around iatom (-2=don't, -1=use_default) within R[A] before (default = *.bef) and after minimization (default = *.aft): 0 5.0 default default Save screen output to file (default=*.out, NULL=don't): default Save optimized configuration on file (default=*, NULL=don't): default