General Data

MgB2

The following data have calculated and added to the database by Jorge Supelano, the student of the High Tech High School, 2000-85th Street North Bergen, NJ 07047. Summer 2001, New Jersey Institute of Technology.

Structure
Lattice Parameter: 5.833000 a.u.
Crystal Structure: b/a= 1.000000 , c/a= 1.141300
1.0 , 0.0 , 0.0
1/2 , sqrt(3)/2 , 0.0
0.0 , 0.0 , 1.0
Basis Atoms:
Mg @ 1 0.0 , 0.0 , 1/2
B @ 2 1/2 , 1/2/sqrt(3) , 0.0
B @ 3 1.0 , 1/sqrt(3) , 0.0