Potential function to be used (NOC): NOC To relax (0) a built-in defect (1) a user-defined configuration: 0 Name of the defect configuration (->*): perfect_crystal_strained User-defined configuration file that could be read in (default=*): default constant_H or constant_S mode: constant_H Default multiplications of the unit cell: 4 4 4 Default external stress (11,12,13,22,23,33) [MPa]: 0. 0. 0. 0. 0. 0. Index of the built-in defect that could be relaxed: 0. perfect_crystal 1. WC 2. C_vacancy 3. Zr_vacancy 4. surface_001 5. ledge_001_a 6. ledge_001_b 7. ledge_001_c 8. ledge_001_d 9. ZrC_995 10. ZrC_99 11. ZrC_98 12. ZrC_97 13. ZrC_96 14. ZrC_95 15. ZrC_90 16. ZrC_80 17. ZrC_70 18. ZrC_60 19. ZrC_50 20. ZrC_40 21. ZrC_30 22. ZrC_20 23. ZrC_10 24. ZrC_0 2 Amplitude of random position perturbations (in lattice constant): 0. Random number generator seed (0->time seed): 0 Minimization tolerance (default=EPS): default Maximum number of evaluations & report frequency (default,inf): default default Save screen output to file (default=*.out, NULL=don't): default Save optimized configuration on file (default=*, NULL=don't): default