# elt lat z ielement atwt # alpha b0 b1 b2 b3 alat esub asub # t0 t1 t2 t3 rozero ibar 'Pt' 'fcc' 12 1 195.080 6.4956062544 4.92 2.20 6.00 2.20 3.9173715678 5.77 0.90 1 3.94 -2.20 3.84 1.00 3 'Ni' 'fcc' 12 1 58.690 5.0842175782 2.56 1.50 6.00 1.50 3.5213917703 4.45 0.94 1 3.10 1.80 4.36 1.00 3