N bcc Sim_LAMMPS_ADP_TseplyaevStarikova_2016_UN__SM_474015477315_000 2.56051342189312 Warning: Maximum number of iterations has been exceeded. C11 = 1300.178013 +/- 0.007336 GPa C12 = 947.692922 +/- 0.005187 GPa C44 = 532.440762 +/- 0.001834 GPa B = 1065.187952 +/- 0.004235 GPa