S fcc SW_ZhouWardMartin_2013_CdTeZnSeHgS__MO_503261197030_003 4.6860006526112565 Optimization terminated successfully. Current function value: -11.380050 Iterations: 76 Function evaluations: 197 C11 = 629.856002 +/- 0.007336 GPa C12 = 609.547219 +/- 0.005187 GPa C44 = 121.112035 +/- 0.001834 GPa B = 616.316813 +/- 0.004235 GPa