NaCl E (Ry) for GGA a (bohr) Gcut 5/10 6/12 7/14 8/16 LAPW 10.00 -0.367565 -0.471790 -0.476692 -0.479532 -0.422764 10.10 -0.371312 -0.475998 -0.480925 -0.483762 -0.426845 10.20 -0.374873 -0.479453 -0.484389 -0.487228 -0.430168 10.30 -0.377729 -0.482200 -0.487164 -0.490001 -0.432795 10.40 -0.380114 -0.484323 -0.489306 -0.492142 -0.434787 10.50 -0.381188 -0.485884 -0.490880 -0.493714 -0.436205 10.60 -0.382212 -0.486926 -0.491935 -0.494767 -0.437127 10.70 -0.382707 -0.487499 -0.492519 -0.495351 -0.437569 10.80 -0.383193 -0.487648 -0.492681 -0.495511 -0.437581 10.90 -0.382782 -0.487424 -0.492458 -0.495288 -0.437211 11.00 -0.381788 -0.486848 -0.491888 -0.494716 -0.436523 11.10 -0.381171 -0.485962 -0.491006 -0.493833 -0.435517 11.20 -0.379851 -0.484797 -0.489841 -0.492667 -0.434218 Parameters from Murnaghan fit: a_0 (Å) 5.70 5.71 5.71 5.71 5.69 B_0 (GPa) 24 23 23 23 24 NaCl E (Ry) for LDA a (bohr) Gcut 5/10 6/12 7/14 8/16 LAPW 10.00 -0.423109 -0.529914 -0.534888 -0.537774 -0.485486 10.10 -0.424461 -0.531732 -0.536716 -0.539595 -0.487109 10.20 -0.425747 -0.532899 -0.537874 -0.540754 -0.488078 10.30 -0.426427 -0.533457 -0.538442 -0.541317 -0.488451 10.40 -0.426736 -0.533479 -0.538470 -0.541343 -0.488297 10.50 -0.425806 -0.533034 -0.538022 -0.540891 -0.487645 10.60 -0.424925 -0.532157 -0.537139 -0.540007 -0.486586 10.70 -0.423580 -0.530893 -0.535874 -0.538736 -0.485130 10.80 -0.422340 -0.529285 -0.534266 -0.537126 -0.483328 10.90 -0.420266 -0.527380 -0.532351 -0.535212 -0.481222 11.00 -0.417688 -0.525197 -0.530165 -0.533024 -0.478860 11.10 -0.415564 -0.522774 -0.527738 -0.530595 -0.476278 11.20 -0.412796 -0.520140 -0.525098 -0.527954 -0.473462 Parameters from Murnaghan fit: a_0 (Å) 5.48 5.48 5.48 5.48 5.46 B_0 (GPa) 31 32 32 32 33