Na E (Ry) for GGA a (bohr) Gcut 5/10 6/12 7/14 8/16 LAPW 7.20 -0.082605 -0.086165 -0.088371 -0.088556 -0.118278 7.30 -0.084489 -0.088072 -0.090281 -0.090468 -0.120180 7.40 -0.086028 -0.089606 -0.091828 -0.092019 -0.121718 7.50 -0.087221 -0.090811 -0.093049 -0.093241 -0.122948 7.60 -0.088128 -0.091715 -0.093974 -0.094168 -0.123865 7.70 -0.088760 -0.092363 -0.094632 -0.094827 -0.124534 7.80 -0.089169 -0.092782 -0.095048 -0.095244 -0.124958 7.90 -0.089351 -0.092967 -0.095245 -0.095443 -0.125155 8.00 -0.089328 -0.092958 -0.095245 -0.095443 -0.125161 Parameters from Murnaghan fit: a_0 (Å) 4.20 4.21 4.21 4.21 4.21 B_0 (GPa) 8 8 8 8 8 Na E (Ry) for LDA a (bohr) Gcut 5/10 6/12 7/14 8/16 LAPW 7.20 -0.097240 -0.100944 -0.103128 -0.103314 -0.175916 7.30 -0.098394 -0.102111 -0.104284 -0.104470 -0.177023 7.40 -0.099244 -0.102946 -0.105121 -0.105307 -0.177801 7.50 -0.099789 -0.103492 -0.105670 -0.105855 -0.178315 7.60 -0.100084 -0.103773 -0.105961 -0.106146 -0.178563 7.70 -0.100140 -0.103833 -0.106021 -0.106205 -0.178583 7.80 -0.100003 -0.103695 -0.105871 -0.106055 -0.178400 7.90 -0.099670 -0.103354 -0.105534 -0.105718 -0.178028 8.00 -0.099161 -0.102848 -0.105029 -0.105212 -0.177490 Parameters from Murnaghan fit: a_0 (Å) 4.06 4.06 4.06 4.06 4.05 B_0 (GPa) 9 9 9 9 9