O sc Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001 2.6012959331274033
Warning: Maximum number of iterations has been exceeded.

C11 = -597848.112014 +/-     0.007336 GPa
C12 = -199274.118593 +/-     0.005187 GPa
C44 = -19921.821056 +/-     0.001834 GPa
B   = -332132.116400 +/-     0.004235 GPa