GaP E (Ry) for GGA a (bohr) Gcut 5/10 6/12 7/14 8/16 LAPW 9.90 -0.386212 -0.628753 -0.648827 -0.656300 -0.563380 10.00 -0.393284 -0.636563 -0.656723 -0.664183 -0.572348 10.10 -0.403337 -0.642547 -0.662792 -0.670175 -0.578480 10.20 -0.404646 -0.646786 -0.667004 -0.674439 -0.583087 10.30 -0.410678 -0.649531 -0.669732 -0.677121 -0.586208 10.40 -0.409447 -0.650763 -0.671005 -0.678379 -0.587622 10.50 -0.409035 -0.650664 -0.670949 -0.678327 -0.587728 10.60 -0.405877 -0.649477 -0.669726 -0.677113 -0.586907 Parameters from Murnaghan fit: a_0 (Å) 5.50 5.53 5.53 5.53 5.54 B_0 (GPa) 128 79 78 78 71 GaP E (Ry) for LDA a (bohr) Gcut 5/10 6/12 7/14 8/16 LAPW 9.90 -0.491455 -0.737383 -0.757520 -0.765068 -0.499925 10.00 -0.495225 -0.741976 -0.762177 -0.769713 -0.505432 10.10 -0.502103 -0.744834 -0.765126 -0.772585 -0.508222 10.20 -0.500161 -0.746089 -0.766333 -0.773846 -0.509767 10.30 -0.503348 -0.745944 -0.766167 -0.773634 -0.509718 10.40 -0.499329 -0.744396 -0.764655 -0.772108 -0.508716 10.50 -0.496096 -0.741617 -0.761919 -0.769376 -0.505894 10.60 -0.490206 -0.737859 -0.758115 -0.765582 -0.502549 Parameters from Murnaghan fit: a_0 (Å) 5.42 5.42 5.42 5.42 5.42 B_0 (GPa) 121 89 90 90 89