# elt lat z ielement atwt # alpha b0 b1 b2 b3 alat esub asub # t0 t1 t2 t3 rozero ibar 'Li' 'bcc' 8 1 6.940 3.0982595559 1.65 1.00 4.00 1.00 3.4871956259 1.65 0.95 1 2.30 5.00 0.50 1.00 3 'Mg' 'hcp' 12 1 24.320 5.5663414489 2.30 1.00 3.00 1.00 3.2000000000 1.55 0.52 1 9.00 -2.00 -9.50 1.00 3