Lattice vectors for rhombohedral cell of BiFeO3
Posted: Wed Nov 05, 2014 1:46 pm
Hi vasp users,
How to calculate the primitive lattice vectors for rhombohedral unit cell for the POSCAR file with the lattice constant of 5.63 and the wyckoff positions are Bi(2a) is 0, Fe(2a) is 0.221 and O(6b) is 0.538, 0.933, 0.395. Kindly help me.
Since I am beginner to vasp kindly answer me if anyone knows........
Thanking you,
How to calculate the primitive lattice vectors for rhombohedral unit cell for the POSCAR file with the lattice constant of 5.63 and the wyckoff positions are Bi(2a) is 0, Fe(2a) is 0.221 and O(6b) is 0.538, 0.933, 0.395. Kindly help me.
Since I am beginner to vasp kindly answer me if anyone knows........
Thanking you,