LAPW0 END 6.164u 0.164s 0:12.69 49.8% 0+0k 0+0io 0pf+0w LAPW1 END 821.859u 3.708s 14:18.62 96.1% 0+0k 0+0io 0pf+0w nargs= 1 argi=dmft1.def mode=g EF= 7.7965175 0) Finished k-point number 1 with #bands= 68 0) Finished k-point number 2 with #bands= 68 0) Finished k-point number 3 with #bands= 68 0) Finished k-point number 4 with #bands= 68 0) Finished k-point number 5 with #bands= 68 0) Finished k-point number 6 with #bands= 67 0) Finished k-point number 7 with #bands= 68 0) Finished k-point number 8 with #bands= 68 0) Finished k-point number 9 with #bands= 68 0) Finished k-point number 10 with #bands= 68 0) Finished k-point number 11 with #bands= 68 0) Finished k-point number 12 with #bands= 69 0) Finished k-point number 13 with #bands= 69 0) Finished k-point number 14 with #bands= 68 0) Finished k-point number 15 with #bands= 68 0) Finished k-point number 16 with #bands= 68 0) Finished k-point number 17 with #bands= 68 0) Finished k-point number 18 with #bands= 68 0) Finished k-point number 19 with #bands= 69 0) Finished k-point number 20 with #bands= 69 0) Finished k-point number 21 with #bands= 68 0) Finished k-point number 22 with #bands= 67 0) Finished k-point number 23 with #bands= 68 0) Finished k-point number 24 with #bands= 68 0) Finished k-point number 25 with #bands= 68 0) Finished k-point number 26 with #bands= 69 0) Finished k-point number 27 with #bands= 68 0) Finished k-point number 28 with #bands= 68 0) Finished k-point number 29 with #bands= 66 0) Finished k-point number 30 with #bands= 67 0) Finished k-point number 31 with #bands= 68 0) Finished k-point number 32 with #bands= 69 0) Finished k-point number 33 with #bands= 68 0) Finished k-point number 34 with #bands= 68 0) Finished k-point number 35 with #bands= 68 0) Finished k-point number 36 with #bands= 66 0) Finished k-point number 37 with #bands= 67 0) Finished k-point number 38 with #bands= 67 0) Finished k-point number 39 with #bands= 68 0) Finished k-point number 40 with #bands= 68 0) Finished k-point number 41 with #bands= 68 0) Finished k-point number 42 with #bands= 68 0) Finished k-point number 43 with #bands= 68 0) Finished k-point number 44 with #bands= 68 0) Finished k-point number 45 with #bands= 68 0) Finished k-point number 46 with #bands= 68 0) Finished k-point number 47 with #bands= 68 0) Finished k-point number 48 with #bands= 68 0) Finished k-point number 49 with #bands= 68 0) Finished k-point number 50 with #bands= 68 0) Finished k-point number 51 with #bands= 68 0) Finished k-point number 52 with #bands= 67 0) Finished k-point number 53 with #bands= 67 0) Finished k-point number 54 with #bands= 68 0) Finished k-point number 55 with #bands= 68 0) Finished k-point number 56 with #bands= 69 0) Finished k-point number 57 with #bands= 69 0) Finished k-point number 58 with #bands= 69 0) Finished k-point number 59 with #bands= 69 0) Finished k-point number 60 with #bands= 68 0) Finished k-point number 61 with #bands= 68 0) Finished k-point number 62 with #bands= 68 0) Finished k-point number 63 with #bands= 67 0) Finished k-point number 64 with #bands= 67 0) Finished k-point number 65 with #bands= 68 0) Finished k-point number 66 with #bands= 68 0) Finished k-point number 67 with #bands= 69 0) Finished k-point number 68 with #bands= 69 0) Finished k-point number 69 with #bands= 69 0) Finished k-point number 70 with #bands= 69 0) Finished k-point number 71 with #bands= 69 0) Finished k-point number 72 with #bands= 69 0) Finished k-point number 73 with #bands= 68 0) Finished k-point number 74 with #bands= 68 0) Finished k-point number 75 with #bands= 67 0) Finished k-point number 76 with #bands= 68 0) Finished k-point number 77 with #bands= 68 0) Finished k-point number 78 with #bands= 69 0) Finished k-point number 79 with #bands= 68 0) Finished k-point number 80 with #bands= 68 0) Finished k-point number 81 with #bands= 68 0) Finished k-point number 82 with #bands= 69 0) Finished k-point number 83 with #bands= 68 0) Finished k-point number 84 with #bands= 69 0) Finished k-point number 85 with #bands= 68 0) Finished k-point number 86 with #bands= 67 0) Finished k-point number 87 with #bands= 68 0) Finished k-point number 88 with #bands= 67 0) Finished k-point number 89 with #bands= 69 0) Finished k-point number 90 with #bands= 68 0) Finished k-point number 91 with #bands= 68 0) Finished k-point number 92 with #bands= 68 0) Finished k-point number 93 with #bands= 68 0) Finished k-point number 94 with #bands= 69 0) Finished k-point number 95 with #bands= 68 0) Finished k-point number 96 with #bands= 67 0) Finished k-point number 97 with #bands= 66 0) Finished k-point number 98 with #bands= 67 0) Finished k-point number 99 with #bands= 67 0) Finished k-point number 100 with #bands= 68 0) Finished k-point number 101 with #bands= 69 0) Finished k-point number 102 with #bands= 68 0) Finished k-point number 103 with #bands= 68 0) Finished k-point number 104 with #bands= 68 0) Finished k-point number 105 with #bands= 68 0) Finished k-point number 106 with #bands= 68 0) Finished k-point number 107 with #bands= 68 0) Finished k-point number 108 with #bands= 67 0) Finished k-point number 109 with #bands= 68 0) Finished k-point number 110 with #bands= 68 0) Finished k-point number 111 with #bands= 69 0) Finished k-point number 112 with #bands= 68 0) Finished k-point number 113 with #bands= 68 0) Finished k-point number 114 with #bands= 66 0) Finished k-point number 115 with #bands= 66 0) Finished k-point number 116 with #bands= 66 0) Finished k-point number 117 with #bands= 67 0) Finished k-point number 118 with #bands= 69 0) Finished k-point number 119 with #bands= 69 0) Finished k-point number 120 with #bands= 69 0) Finished k-point number 121 with #bands= 68 0) Finished k-point number 122 with #bands= 68 0) Finished k-point number 123 with #bands= 67 0) Finished k-point number 124 with #bands= 66 0) Finished k-point number 125 with #bands= 66 0) Finished k-point number 126 with #bands= 66 0) Finished k-point number 127 with #bands= 69 0) Finished k-point number 128 with #bands= 69 0) Finished k-point number 129 with #bands= 69 0) Finished k-point number 130 with #bands= 68 0) Finished k-point number 131 with #bands= 68 0) Finished k-point number 132 with #bands= 68 0) Finished k-point number 133 with #bands= 67 0) Finished k-point number 134 with #bands= 66 0) Finished k-point number 135 with #bands= 67 0) Finished k-point number 136 with #bands= 69 0) Finished k-point number 137 with #bands= 68 0) Finished k-point number 138 with #bands= 68 0) Finished k-point number 139 with #bands= 68 0) Finished k-point number 140 with #bands= 69 0) Finished k-point number 141 with #bands= 68 0) Finished k-point number 142 with #bands= 69 0) Finished k-point number 143 with #bands= 68 0) Finished k-point number 144 with #bands= 67 0) Finished k-point number 145 with #bands= 69 0) Finished k-point number 146 with #bands= 69 0) Finished k-point number 147 with #bands= 68 0) Finished k-point number 148 with #bands= 68 0) Finished k-point number 149 with #bands= 68 0) Finished k-point number 150 with #bands= 69 0) Finished k-point number 151 with #bands= 69 0) Finished k-point number 152 with #bands= 68 0) Finished k-point number 153 with #bands= 68 0) Finished k-point number 154 with #bands= 69 0) Finished k-point number 155 with #bands= 69 0) Finished k-point number 156 with #bands= 69 0) Finished k-point number 157 with #bands= 68 0) Finished k-point number 158 with #bands= 68 0) Finished k-point number 159 with #bands= 68 0) Finished k-point number 160 with #bands= 68 0) Finished k-point number 161 with #bands= 68 0) Finished k-point number 162 with #bands= 67 0) Finished k-point number 163 with #bands= 69 0) Finished k-point number 164 with #bands= 67 0) Finished k-point number 165 with #bands= 67 0) Finished k-point number 166 with #bands= 66 0) Finished k-point number 167 with #bands= 66 0) Finished k-point number 168 with #bands= 66 0) Finished k-point number 169 with #bands= 66 0) Finished k-point number 170 with #bands= 69 0) Finished k-point number 171 with #bands= 68 0) Finished k-point number 172 with #bands= 67 0) Finished k-point number 173 with #bands= 67 0) Finished k-point number 174 with #bands= 66 0) Finished k-point number 175 with #bands= 66 0) Finished k-point number 176 with #bands= 66 0) Finished k-point number 177 with #bands= 69 0) Finished k-point number 178 with #bands= 68 0) Finished k-point number 179 with #bands= 67 0) Finished k-point number 180 with #bands= 67 0) Finished k-point number 181 with #bands= 67 0) Finished k-point number 182 with #bands= 67 0) Finished k-point number 183 with #bands= 66 0) Finished k-point number 184 with #bands= 68 0) Finished k-point number 185 with #bands= 68 0) Finished k-point number 186 with #bands= 67 0) Finished k-point number 187 with #bands= 67 0) Finished k-point number 188 with #bands= 68 0) Finished k-point number 189 with #bands= 68 0) Finished k-point number 190 with #bands= 68 0) Finished k-point number 191 with #bands= 69 0) Finished k-point number 192 with #bands= 68 0) Finished k-point number 193 with #bands= 68 0) Finished k-point number 194 with #bands= 69 0) Finished k-point number 195 with #bands= 69 0) Finished k-point number 196 with #bands= 69 0) Finished k-point number 197 with #bands= 68 0) Finished k-point number 198 with #bands= 69 0) Finished k-point number 199 with #bands= 68 0) Finished k-point number 200 with #bands= 68 0) Finished k-point number 201 with #bands= 68 0) Finished k-point number 202 with #bands= 70 0) Finished k-point number 203 with #bands= 70 0) Finished k-point number 204 with #bands= 68 0) Finished k-point number 205 with #bands= 66 0) Finished k-point number 206 with #bands= 66 0) Finished k-point number 207 with #bands= 66 0) Finished k-point number 208 with #bands= 66 0) Finished k-point number 209 with #bands= 66 0) Finished k-point number 210 with #bands= 66 0) Finished k-point number 211 with #bands= 67 0) Finished k-point number 212 with #bands= 67 0) Finished k-point number 213 with #bands= 66 0) Finished k-point number 214 with #bands= 66 0) Finished k-point number 215 with #bands= 67 0) Finished k-point number 216 with #bands= 67 0) Finished k-point number 217 with #bands= 67 0) Finished k-point number 218 with #bands= 67 0) Finished k-point number 219 with #bands= 67 0) Finished k-point number 220 with #bands= 67 0) Finished k-point number 221 with #bands= 67 0) Finished k-point number 222 with #bands= 68 0) Finished k-point number 223 with #bands= 67 0) Finished k-point number 224 with #bands= 67 0) Finished k-point number 225 with #bands= 68 0) Finished k-point number 226 with #bands= 68 0) Finished k-point number 227 with #bands= 69 0) Finished k-point number 228 with #bands= 69 0) Finished k-point number 229 with #bands= 68 0) Finished k-point number 230 with #bands= 68 0) Finished k-point number 231 with #bands= 69 0) Finished k-point number 232 with #bands= 70 0) Finished k-point number 233 with #bands= 70 0) Finished k-point number 234 with #bands= 69 0) Finished k-point number 235 with #bands= 67 0) Finished k-point number 236 with #bands= 67 0) Finished k-point number 237 with #bands= 66 0) Finished k-point number 238 with #bands= 67 0) Finished k-point number 239 with #bands= 67 0) Finished k-point number 240 with #bands= 67 0) Finished k-point number 241 with #bands= 67 0) Finished k-point number 242 with #bands= 67 0) Finished k-point number 243 with #bands= 67 0) Finished k-point number 244 with #bands= 67 0) Finished k-point number 245 with #bands= 67 0) Finished k-point number 246 with #bands= 67 0) Finished k-point number 247 with #bands= 69 0) Finished k-point number 248 with #bands= 69 0) Finished k-point number 249 with #bands= 68 0) Finished k-point number 250 with #bands= 70 0) Finished k-point number 251 with #bands= 70 0) Finished k-point number 252 with #bands= 70 0) Finished k-point number 253 with #bands= 68 0) Finished k-point number 254 with #bands= 67 0) Finished k-point number 255 with #bands= 67 0) Finished k-point number 256 with #bands= 67 0) Finished k-point number 257 with #bands= 68 0) Finished k-point number 258 with #bands= 71 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.969120248516938 0.975211955465417 0.972083095658824 0.972075851584740 0.968659769136296 0.969120248516938 0.975211955465417 0.972083095658824 0.972075851584740 0.968659769136296 0.969143427295243 0.975235927739713 0.972105831053140 0.972094945899881 0.968676031755796 0.969143427295243 0.975235927739713 0.972105831053140 0.972094945899881 0.968676031755796 0) Finished k-point number 1 with #bands= 68 0) Finished k-point number 2 with #bands= 68 0) Finished k-point number 3 with #bands= 68 0) Finished k-point number 4 with #bands= 68 0) Finished k-point number 5 with #bands= 68 0) Finished k-point number 6 with #bands= 67 0) Finished k-point number 7 with #bands= 68 0) Finished k-point number 8 with #bands= 68 0) Finished k-point number 9 with #bands= 68 0) Finished k-point number 10 with #bands= 68 0) Finished k-point number 11 with #bands= 68 0) Finished k-point number 12 with #bands= 69 0) Finished k-point number 13 with #bands= 69 0) Finished k-point number 14 with #bands= 68 0) Finished k-point number 15 with #bands= 68 0) Finished k-point number 16 with #bands= 68 0) Finished k-point number 17 with #bands= 68 0) Finished k-point number 18 with #bands= 68 0) Finished k-point number 19 with #bands= 69 0) Finished k-point number 20 with #bands= 69 0) Finished k-point number 21 with #bands= 68 0) Finished k-point number 22 with #bands= 67 0) Finished k-point number 23 with #bands= 68 0) Finished k-point number 24 with #bands= 68 0) Finished k-point number 25 with #bands= 68 0) Finished k-point number 26 with #bands= 69 0) Finished k-point number 27 with #bands= 68 0) Finished k-point number 28 with #bands= 68 0) Finished k-point number 29 with #bands= 66 0) Finished k-point number 30 with #bands= 67 0) Finished k-point number 31 with #bands= 68 0) Finished k-point number 32 with #bands= 69 0) Finished k-point number 33 with #bands= 68 0) Finished k-point number 34 with #bands= 68 0) Finished k-point number 35 with #bands= 68 0) Finished k-point number 36 with #bands= 66 0) Finished k-point number 37 with #bands= 67 0) Finished k-point number 38 with #bands= 67 0) Finished k-point number 39 with #bands= 68 0) Finished k-point number 40 with #bands= 68 0) Finished k-point number 41 with #bands= 68 0) Finished k-point number 42 with #bands= 68 0) Finished k-point number 43 with #bands= 68 0) Finished k-point number 44 with #bands= 68 0) Finished k-point number 45 with #bands= 68 0) Finished k-point number 46 with #bands= 68 0) Finished k-point number 47 with #bands= 68 0) Finished k-point number 48 with #bands= 68 0) Finished k-point number 49 with #bands= 68 0) Finished k-point number 50 with #bands= 68 0) Finished k-point number 51 with #bands= 68 0) Finished k-point number 52 with #bands= 67 0) Finished k-point number 53 with #bands= 67 0) Finished k-point number 54 with #bands= 68 0) Finished k-point number 55 with #bands= 68 0) Finished k-point number 56 with #bands= 69 0) Finished k-point number 57 with #bands= 69 0) Finished k-point number 58 with #bands= 69 0) Finished k-point number 59 with #bands= 69 0) Finished k-point number 60 with #bands= 68 0) Finished k-point number 61 with #bands= 68 0) Finished k-point number 62 with #bands= 68 0) Finished k-point number 63 with #bands= 67 0) Finished k-point number 64 with #bands= 67 0) Finished k-point number 65 with #bands= 68 0) Finished k-point number 66 with #bands= 68 0) Finished k-point number 67 with #bands= 69 0) Finished k-point number 68 with #bands= 69 0) Finished k-point number 69 with #bands= 69 0) Finished k-point number 70 with #bands= 69 0) Finished k-point number 71 with #bands= 69 0) Finished k-point number 72 with #bands= 69 0) Finished k-point number 73 with #bands= 68 0) Finished k-point number 74 with #bands= 68 0) Finished k-point number 75 with #bands= 67 0) Finished k-point number 76 with #bands= 68 0) Finished k-point number 77 with #bands= 68 0) Finished k-point number 78 with #bands= 69 0) Finished k-point number 79 with #bands= 68 0) Finished k-point number 80 with #bands= 68 0) Finished k-point number 81 with #bands= 68 0) Finished k-point number 82 with #bands= 69 0) Finished k-point number 83 with #bands= 68 0) Finished k-point number 84 with #bands= 69 0) Finished k-point number 85 with #bands= 68 0) Finished k-point number 86 with #bands= 67 0) Finished k-point number 87 with #bands= 68 0) Finished k-point number 88 with #bands= 67 0) Finished k-point number 89 with #bands= 69 0) Finished k-point number 90 with #bands= 68 0) Finished k-point number 91 with #bands= 68 0) Finished k-point number 92 with #bands= 68 0) Finished k-point number 93 with #bands= 68 0) Finished k-point number 94 with #bands= 69 0) Finished k-point number 95 with #bands= 68 0) Finished k-point number 96 with #bands= 67 0) Finished k-point number 97 with #bands= 66 0) Finished k-point number 98 with #bands= 67 0) Finished k-point number 99 with #bands= 67 0) Finished k-point number 100 with #bands= 68 0) Finished k-point number 101 with #bands= 69 0) Finished k-point number 102 with #bands= 68 0) Finished k-point number 103 with #bands= 68 0) Finished k-point number 104 with #bands= 68 0) Finished k-point number 105 with #bands= 68 0) Finished k-point number 106 with #bands= 68 0) Finished k-point number 107 with #bands= 68 0) Finished k-point number 108 with #bands= 67 0) Finished k-point number 109 with #bands= 68 0) Finished k-point number 110 with #bands= 68 0) Finished k-point number 111 with #bands= 69 0) Finished k-point number 112 with #bands= 68 0) Finished k-point number 113 with #bands= 68 0) Finished k-point number 114 with #bands= 66 0) Finished k-point number 115 with #bands= 66 0) Finished k-point number 116 with #bands= 66 0) Finished k-point number 117 with #bands= 67 0) Finished k-point number 118 with #bands= 69 0) Finished k-point number 119 with #bands= 69 0) Finished k-point number 120 with #bands= 69 0) Finished k-point number 121 with #bands= 68 0) Finished k-point number 122 with #bands= 68 0) Finished k-point number 123 with #bands= 67 0) Finished k-point number 124 with #bands= 66 0) Finished k-point number 125 with #bands= 66 0) Finished k-point number 126 with #bands= 66 0) Finished k-point number 127 with #bands= 69 0) Finished k-point number 128 with #bands= 69 0) Finished k-point number 129 with #bands= 69 0) Finished k-point number 130 with #bands= 68 0) Finished k-point number 131 with #bands= 68 0) Finished k-point number 132 with #bands= 68 0) Finished k-point number 133 with #bands= 67 0) Finished k-point number 134 with #bands= 66 0) Finished k-point number 135 with #bands= 67 0) Finished k-point number 136 with #bands= 69 0) Finished k-point number 137 with #bands= 68 0) Finished k-point number 138 with #bands= 68 0) Finished k-point number 139 with #bands= 68 0) Finished k-point number 140 with #bands= 69 0) Finished k-point number 141 with #bands= 68 0) Finished k-point number 142 with #bands= 69 0) Finished k-point number 143 with #bands= 68 0) Finished k-point number 144 with #bands= 67 0) Finished k-point number 145 with #bands= 69 0) Finished k-point number 146 with #bands= 69 0) Finished k-point number 147 with #bands= 68 0) Finished k-point number 148 with #bands= 68 0) Finished k-point number 149 with #bands= 68 0) Finished k-point number 150 with #bands= 69 0) Finished k-point number 151 with #bands= 69 0) Finished k-point number 152 with #bands= 68 0) Finished k-point number 153 with #bands= 68 0) Finished k-point number 154 with #bands= 69 0) Finished k-point number 155 with #bands= 69 0) Finished k-point number 156 with #bands= 69 0) Finished k-point number 157 with #bands= 68 0) Finished k-point number 158 with #bands= 68 0) Finished k-point number 159 with #bands= 68 0) Finished k-point number 160 with #bands= 68 0) Finished k-point number 161 with #bands= 68 0) Finished k-point number 162 with #bands= 67 0) Finished k-point number 163 with #bands= 69 0) Finished k-point number 164 with #bands= 67 0) Finished k-point number 165 with #bands= 67 0) Finished k-point number 166 with #bands= 66 0) Finished k-point number 167 with #bands= 66 0) Finished k-point number 168 with #bands= 66 0) Finished k-point number 169 with #bands= 66 0) Finished k-point number 170 with #bands= 69 0) Finished k-point number 171 with #bands= 68 0) Finished k-point number 172 with #bands= 67 0) Finished k-point number 173 with #bands= 67 0) Finished k-point number 174 with #bands= 66 0) Finished k-point number 175 with #bands= 66 0) Finished k-point number 176 with #bands= 66 0) Finished k-point number 177 with #bands= 69 0) Finished k-point number 178 with #bands= 68 0) Finished k-point number 179 with #bands= 67 0) Finished k-point number 180 with #bands= 67 0) Finished k-point number 181 with #bands= 67 0) Finished k-point number 182 with #bands= 67 0) Finished k-point number 183 with #bands= 66 0) Finished k-point number 184 with #bands= 68 0) Finished k-point number 185 with #bands= 68 0) Finished k-point number 186 with #bands= 67 0) Finished k-point number 187 with #bands= 67 0) Finished k-point number 188 with #bands= 68 0) Finished k-point number 189 with #bands= 68 0) Finished k-point number 190 with #bands= 68 0) Finished k-point number 191 with #bands= 69 0) Finished k-point number 192 with #bands= 68 0) Finished k-point number 193 with #bands= 68 0) Finished k-point number 194 with #bands= 69 0) Finished k-point number 195 with #bands= 69 0) Finished k-point number 196 with #bands= 69 0) Finished k-point number 197 with #bands= 68 0) Finished k-point number 198 with #bands= 69 0) Finished k-point number 199 with #bands= 68 0) Finished k-point number 200 with #bands= 68 0) Finished k-point number 201 with #bands= 68 0) Finished k-point number 202 with #bands= 70 0) Finished k-point number 203 with #bands= 70 0) Finished k-point number 204 with #bands= 68 0) Finished k-point number 205 with #bands= 66 0) Finished k-point number 206 with #bands= 66 0) Finished k-point number 207 with #bands= 66 0) Finished k-point number 208 with #bands= 66 0) Finished k-point number 209 with #bands= 66 0) Finished k-point number 210 with #bands= 66 0) Finished k-point number 211 with #bands= 67 0) Finished k-point number 212 with #bands= 67 0) Finished k-point number 213 with #bands= 66 0) Finished k-point number 214 with #bands= 66 0) Finished k-point number 215 with #bands= 67 0) Finished k-point number 216 with #bands= 67 0) Finished k-point number 217 with #bands= 67 0) Finished k-point number 218 with #bands= 67 0) Finished k-point number 219 with #bands= 67 0) Finished k-point number 220 with #bands= 67 0) Finished k-point number 221 with #bands= 67 0) Finished k-point number 222 with #bands= 68 0) Finished k-point number 223 with #bands= 67 0) Finished k-point number 224 with #bands= 67 0) Finished k-point number 225 with #bands= 68 0) Finished k-point number 226 with #bands= 68 0) Finished k-point number 227 with #bands= 69 0) Finished k-point number 228 with #bands= 69 0) Finished k-point number 229 with #bands= 68 0) Finished k-point number 230 with #bands= 68 0) Finished k-point number 231 with #bands= 69 0) Finished k-point number 232 with #bands= 70 0) Finished k-point number 233 with #bands= 70 0) Finished k-point number 234 with #bands= 69 0) Finished k-point number 235 with #bands= 67 0) Finished k-point number 236 with #bands= 67 0) Finished k-point number 237 with #bands= 66 0) Finished k-point number 238 with #bands= 67 0) Finished k-point number 239 with #bands= 67 0) Finished k-point number 240 with #bands= 67 0) Finished k-point number 241 with #bands= 67 0) Finished k-point number 242 with #bands= 67 0) Finished k-point number 243 with #bands= 67 0) Finished k-point number 244 with #bands= 67 0) Finished k-point number 245 with #bands= 67 0) Finished k-point number 246 with #bands= 67 0) Finished k-point number 247 with #bands= 69 0) Finished k-point number 248 with #bands= 69 0) Finished k-point number 249 with #bands= 68 0) Finished k-point number 250 with #bands= 70 0) Finished k-point number 251 with #bands= 70 0) Finished k-point number 252 with #bands= 70 0) Finished k-point number 253 with #bands= 68 0) Finished k-point number 254 with #bands= 67 0) Finished k-point number 255 with #bands= 67 0) Finished k-point number 256 with #bands= 67 0) Finished k-point number 257 with #bands= 68 0) Finished k-point number 258 with #bands= 71 Eimp= -1.48358068602641 -1.59157559074279 -1.38145535002754 -1.40653597253919 -1.41538461313950 -1.48358068602641 -1.59157559074279 -1.38145535002754 -1.40653597253919 -1.41538461313950 -1.48606208872340 -1.59498372911576 -1.38608033600911 -1.40884128921291 -1.41750175154718 -1.48606208872340 -1.59498372911576 -1.38608033600911 -1.40884128921291 -1.41750175154718 final Z due to interstitals= 1.00000000000000 0.999999999999998 1.00000000000000 1.00000000000000 0.999999999999999 1.00000000000000 0.999999999999998 1.00000000000000 1.00000000000000 0.999999999999999 0.999999999999992 0.999999999999997 0.999999999999999 1.00000000000000 0.999999999999993 0.999999999999992 0.999999999999998 0.999999999999999 1.00000000000000 0.999999999999993 DMFT END DmftEnvironment: mpi_prefix.dat exists -- running in parallel mode. /opt/mpich2/intel/10.1/bin/mpiexec -env LD_LIBRARY_PATH /opt/intel/mkl/9.0/lib/em64t -port 30048 -np 1 -machinefile /tmp/260048.1.wsp64_hp/machines case= Ba122 root= /home/yinzping/bin/DMFT2/bin cixs= [1, 2, 3, 4] NOE= 136.0 opening Ba122.scf2 Ef= 7.79646964665 Found DMFT-mu= 7.79651751693 ..... running: /home/yinzping/bin/DMFT2/bin/ssplit.py -n 100 -t 30 case=Ba122, nom=100, ntail=30, insig=sig.inp, outsig=sig.inp[1-n] s_oo= [27.007316985290249, 27.119162714308967, 27.138336338739609, 27.411485089007058, 27.254949368990726, 25.821942480953968, 26.132609882093504, 25.987710841084652, 25.815029824424645, 25.614447988293492, 25.783852896714425, 26.106028406951005, 25.936375371253998, 25.787140536868566, 25.571066112732399, 27.04697838792535, 27.149529756158575, 27.204713601988566, 27.455615572391636, 27.299478461795395] Edc= [25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75] ..... Going over all correlated blocks icix= 1 cols= [1, 2, 3, 4, 5] icix= 2 cols= [1, 2, 3, 4, 5] icix= 3 cols= [11, 12, 13, 14, 15] icix= 4 cols= [11, 12, 13, 14, 15] ..... running: /opt/mpich2/intel/10.1/bin/mpiexec -env LD_LIBRARY_PATH /opt/intel/mkl/9.0/lib/em64t -port 30048 -np 1 -machinefile /tmp/260048.1.wsp64_hp/machines ./dmft dmft1.def nargs= 1 argi=dmft1dn.def mode=g EF= 7.7965175 0) Finished k-point number 1 with #bands= 68 0) Finished k-point number 2 with #bands= 68 0) Finished k-point number 3 with #bands= 68 0) Finished k-point number 4 with #bands= 68 0) Finished k-point number 5 with #bands= 68 0) Finished k-point number 6 with #bands= 67 0) Finished k-point number 7 with #bands= 68 0) Finished k-point number 8 with #bands= 68 0) Finished k-point number 9 with #bands= 68 0) Finished k-point number 10 with #bands= 68 0) Finished k-point number 11 with #bands= 68 0) Finished k-point number 12 with #bands= 69 0) Finished k-point number 13 with #bands= 69 0) Finished k-point number 14 with #bands= 68 0) Finished k-point number 15 with #bands= 68 0) Finished k-point number 16 with #bands= 68 0) Finished k-point number 17 with #bands= 68 0) Finished k-point number 18 with #bands= 68 0) Finished k-point number 19 with #bands= 69 0) Finished k-point number 20 with #bands= 69 0) Finished k-point number 21 with #bands= 68 0) Finished k-point number 22 with #bands= 67 0) Finished k-point number 23 with #bands= 68 0) Finished k-point number 24 with #bands= 68 0) Finished k-point number 25 with #bands= 68 0) Finished k-point number 26 with #bands= 69 0) Finished k-point number 27 with #bands= 68 0) Finished k-point number 28 with #bands= 68 0) Finished k-point number 29 with #bands= 66 0) Finished k-point number 30 with #bands= 67 0) Finished k-point number 31 with #bands= 68 0) Finished k-point number 32 with #bands= 69 0) Finished k-point number 33 with #bands= 68 0) Finished k-point number 34 with #bands= 68 0) Finished k-point number 35 with #bands= 68 0) Finished k-point number 36 with #bands= 66 0) Finished k-point number 37 with #bands= 67 0) Finished k-point number 38 with #bands= 67 0) Finished k-point number 39 with #bands= 68 0) Finished k-point number 40 with #bands= 68 0) Finished k-point number 41 with #bands= 68 0) Finished k-point number 42 with #bands= 68 0) Finished k-point number 43 with #bands= 68 0) Finished k-point number 44 with #bands= 68 0) Finished k-point number 45 with #bands= 68 0) Finished k-point number 46 with #bands= 68 0) Finished k-point number 47 with #bands= 68 0) Finished k-point number 48 with #bands= 68 0) Finished k-point number 49 with #bands= 68 0) Finished k-point number 50 with #bands= 68 0) Finished k-point number 51 with #bands= 68 0) Finished k-point number 52 with #bands= 67 0) Finished k-point number 53 with #bands= 67 0) Finished k-point number 54 with #bands= 68 0) Finished k-point number 55 with #bands= 68 0) Finished k-point number 56 with #bands= 69 0) Finished k-point number 57 with #bands= 69 0) Finished k-point number 58 with #bands= 69 0) Finished k-point number 59 with #bands= 69 0) Finished k-point number 60 with #bands= 68 0) Finished k-point number 61 with #bands= 68 0) Finished k-point number 62 with #bands= 68 0) Finished k-point number 63 with #bands= 67 0) Finished k-point number 64 with #bands= 67 0) Finished k-point number 65 with #bands= 68 0) Finished k-point number 66 with #bands= 68 0) Finished k-point number 67 with #bands= 69 0) Finished k-point number 68 with #bands= 69 0) Finished k-point number 69 with #bands= 69 0) Finished k-point number 70 with #bands= 69 0) Finished k-point number 71 with #bands= 69 0) Finished k-point number 72 with #bands= 69 0) Finished k-point number 73 with #bands= 68 0) Finished k-point number 74 with #bands= 68 0) Finished k-point number 75 with #bands= 67 0) Finished k-point number 76 with #bands= 68 0) Finished k-point number 77 with #bands= 68 0) Finished k-point number 78 with #bands= 69 0) Finished k-point number 79 with #bands= 68 0) Finished k-point number 80 with #bands= 68 0) Finished k-point number 81 with #bands= 68 0) Finished k-point number 82 with #bands= 69 0) Finished k-point number 83 with #bands= 68 0) Finished k-point number 84 with #bands= 69 0) Finished k-point number 85 with #bands= 68 0) Finished k-point number 86 with #bands= 67 0) Finished k-point number 87 with #bands= 68 0) Finished k-point number 88 with #bands= 67 0) Finished k-point number 89 with #bands= 69 0) Finished k-point number 90 with #bands= 68 0) Finished k-point number 91 with #bands= 68 0) Finished k-point number 92 with #bands= 68 0) Finished k-point number 93 with #bands= 68 0) Finished k-point number 94 with #bands= 69 0) Finished k-point number 95 with #bands= 68 0) Finished k-point number 96 with #bands= 67 0) Finished k-point number 97 with #bands= 66 0) Finished k-point number 98 with #bands= 67 0) Finished k-point number 99 with #bands= 67 0) Finished k-point number 100 with #bands= 68 0) Finished k-point number 101 with #bands= 69 0) Finished k-point number 102 with #bands= 68 0) Finished k-point number 103 with #bands= 68 0) Finished k-point number 104 with #bands= 68 0) Finished k-point number 105 with #bands= 68 0) Finished k-point number 106 with #bands= 68 0) Finished k-point number 107 with #bands= 68 0) Finished k-point number 108 with #bands= 67 0) Finished k-point number 109 with #bands= 68 0) Finished k-point number 110 with #bands= 68 0) Finished k-point number 111 with #bands= 69 0) Finished k-point number 112 with #bands= 68 0) Finished k-point number 113 with #bands= 68 0) Finished k-point number 114 with #bands= 66 0) Finished k-point number 115 with #bands= 66 0) Finished k-point number 116 with #bands= 66 0) Finished k-point number 117 with #bands= 67 0) Finished k-point number 118 with #bands= 69 0) Finished k-point number 119 with #bands= 69 0) Finished k-point number 120 with #bands= 69 0) Finished k-point number 121 with #bands= 68 0) Finished k-point number 122 with #bands= 68 0) Finished k-point number 123 with #bands= 67 0) Finished k-point number 124 with #bands= 66 0) Finished k-point number 125 with #bands= 66 0) Finished k-point number 126 with #bands= 66 0) Finished k-point number 127 with #bands= 69 0) Finished k-point number 128 with #bands= 69 0) Finished k-point number 129 with #bands= 69 0) Finished k-point number 130 with #bands= 68 0) Finished k-point number 131 with #bands= 68 0) Finished k-point number 132 with #bands= 68 0) Finished k-point number 133 with #bands= 67 0) Finished k-point number 134 with #bands= 66 0) Finished k-point number 135 with #bands= 67 0) Finished k-point number 136 with #bands= 69 0) Finished k-point number 137 with #bands= 68 0) Finished k-point number 138 with #bands= 68 0) Finished k-point number 139 with #bands= 68 0) Finished k-point number 140 with #bands= 69 0) Finished k-point number 141 with #bands= 68 0) Finished k-point number 142 with #bands= 69 0) Finished k-point number 143 with #bands= 68 0) Finished k-point number 144 with #bands= 67 0) Finished k-point number 145 with #bands= 69 0) Finished k-point number 146 with #bands= 69 0) Finished k-point number 147 with #bands= 68 0) Finished k-point number 148 with #bands= 68 0) Finished k-point number 149 with #bands= 68 0) Finished k-point number 150 with #bands= 69 0) Finished k-point number 151 with #bands= 69 0) Finished k-point number 152 with #bands= 68 0) Finished k-point number 153 with #bands= 68 0) Finished k-point number 154 with #bands= 69 0) Finished k-point number 155 with #bands= 69 0) Finished k-point number 156 with #bands= 69 0) Finished k-point number 157 with #bands= 68 0) Finished k-point number 158 with #bands= 68 0) Finished k-point number 159 with #bands= 68 0) Finished k-point number 160 with #bands= 68 0) Finished k-point number 161 with #bands= 68 0) Finished k-point number 162 with #bands= 67 0) Finished k-point number 163 with #bands= 69 0) Finished k-point number 164 with #bands= 67 0) Finished k-point number 165 with #bands= 67 0) Finished k-point number 166 with #bands= 66 0) Finished k-point number 167 with #bands= 66 0) Finished k-point number 168 with #bands= 66 0) Finished k-point number 169 with #bands= 66 0) Finished k-point number 170 with #bands= 69 0) Finished k-point number 171 with #bands= 68 0) Finished k-point number 172 with #bands= 67 0) Finished k-point number 173 with #bands= 67 0) Finished k-point number 174 with #bands= 66 0) Finished k-point number 175 with #bands= 66 0) Finished k-point number 176 with #bands= 66 0) Finished k-point number 177 with #bands= 69 0) Finished k-point number 178 with #bands= 68 0) Finished k-point number 179 with #bands= 67 0) Finished k-point number 180 with #bands= 67 0) Finished k-point number 181 with #bands= 67 0) Finished k-point number 182 with #bands= 67 0) Finished k-point number 183 with #bands= 66 0) Finished k-point number 184 with #bands= 68 0) Finished k-point number 185 with #bands= 68 0) Finished k-point number 186 with #bands= 67 0) Finished k-point number 187 with #bands= 67 0) Finished k-point number 188 with #bands= 68 0) Finished k-point number 189 with #bands= 68 0) Finished k-point number 190 with #bands= 68 0) Finished k-point number 191 with #bands= 69 0) Finished k-point number 192 with #bands= 68 0) Finished k-point number 193 with #bands= 68 0) Finished k-point number 194 with #bands= 69 0) Finished k-point number 195 with #bands= 69 0) Finished k-point number 196 with #bands= 69 0) Finished k-point number 197 with #bands= 68 0) Finished k-point number 198 with #bands= 69 0) Finished k-point number 199 with #bands= 68 0) Finished k-point number 200 with #bands= 68 0) Finished k-point number 201 with #bands= 68 0) Finished k-point number 202 with #bands= 70 0) Finished k-point number 203 with #bands= 70 0) Finished k-point number 204 with #bands= 68 0) Finished k-point number 205 with #bands= 66 0) Finished k-point number 206 with #bands= 66 0) Finished k-point number 207 with #bands= 66 0) Finished k-point number 208 with #bands= 66 0) Finished k-point number 209 with #bands= 66 0) Finished k-point number 210 with #bands= 66 0) Finished k-point number 211 with #bands= 67 0) Finished k-point number 212 with #bands= 67 0) Finished k-point number 213 with #bands= 66 0) Finished k-point number 214 with #bands= 66 0) Finished k-point number 215 with #bands= 67 0) Finished k-point number 216 with #bands= 67 0) Finished k-point number 217 with #bands= 67 0) Finished k-point number 218 with #bands= 67 0) Finished k-point number 219 with #bands= 67 0) Finished k-point number 220 with #bands= 67 0) Finished k-point number 221 with #bands= 67 0) Finished k-point number 222 with #bands= 68 0) Finished k-point number 223 with #bands= 67 0) Finished k-point number 224 with #bands= 67 0) Finished k-point number 225 with #bands= 68 0) Finished k-point number 226 with #bands= 68 0) Finished k-point number 227 with #bands= 69 0) Finished k-point number 228 with #bands= 69 0) Finished k-point number 229 with #bands= 68 0) Finished k-point number 230 with #bands= 68 0) Finished k-point number 231 with #bands= 69 0) Finished k-point number 232 with #bands= 70 0) Finished k-point number 233 with #bands= 70 0) Finished k-point number 234 with #bands= 69 0) Finished k-point number 235 with #bands= 67 0) Finished k-point number 236 with #bands= 67 0) Finished k-point number 237 with #bands= 66 0) Finished k-point number 238 with #bands= 67 0) Finished k-point number 239 with #bands= 67 0) Finished k-point number 240 with #bands= 67 0) Finished k-point number 241 with #bands= 67 0) Finished k-point number 242 with #bands= 67 0) Finished k-point number 243 with #bands= 67 0) Finished k-point number 244 with #bands= 67 0) Finished k-point number 245 with #bands= 67 0) Finished k-point number 246 with #bands= 67 0) Finished k-point number 247 with #bands= 69 0) Finished k-point number 248 with #bands= 69 0) Finished k-point number 249 with #bands= 68 0) Finished k-point number 250 with #bands= 70 0) Finished k-point number 251 with #bands= 70 0) Finished k-point number 252 with #bands= 70 0) Finished k-point number 253 with #bands= 68 0) Finished k-point number 254 with #bands= 67 0) Finished k-point number 255 with #bands= 67 0) Finished k-point number 256 with #bands= 67 0) Finished k-point number 257 with #bands= 68 0) Finished k-point number 258 with #bands= 71 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.969120248516938 0.975211955465417 0.972083095658824 0.972075851584740 0.968659769136296 0.969120248516938 0.975211955465417 0.972083095658824 0.972075851584740 0.968659769136296 0.969143427295243 0.975235927739713 0.972105831053140 0.972094945899881 0.968676031755796 0.969143427295243 0.975235927739713 0.972105831053140 0.972094945899881 0.968676031755796 0) Finished k-point number 1 with #bands= 68 0) Finished k-point number 2 with #bands= 68 0) Finished k-point number 3 with #bands= 68 0) Finished k-point number 4 with #bands= 68 0) Finished k-point number 5 with #bands= 68 0) Finished k-point number 6 with #bands= 67 0) Finished k-point number 7 with #bands= 68 0) Finished k-point number 8 with #bands= 68 0) Finished k-point number 9 with #bands= 68 0) Finished k-point number 10 with #bands= 68 0) Finished k-point number 11 with #bands= 68 0) Finished k-point number 12 with #bands= 69 0) Finished k-point number 13 with #bands= 69 0) Finished k-point number 14 with #bands= 68 0) Finished k-point number 15 with #bands= 68 0) Finished k-point number 16 with #bands= 68 0) Finished k-point number 17 with #bands= 68 0) Finished k-point number 18 with #bands= 68 0) Finished k-point number 19 with #bands= 69 0) Finished k-point number 20 with #bands= 69 0) Finished k-point number 21 with #bands= 68 0) Finished k-point number 22 with #bands= 67 0) Finished k-point number 23 with #bands= 68 0) Finished k-point number 24 with #bands= 68 0) Finished k-point number 25 with #bands= 68 0) Finished k-point number 26 with #bands= 69 0) Finished k-point number 27 with #bands= 68 0) Finished k-point number 28 with #bands= 68 0) Finished k-point number 29 with #bands= 66 0) Finished k-point number 30 with #bands= 67 0) Finished k-point number 31 with #bands= 68 0) Finished k-point number 32 with #bands= 69 0) Finished k-point number 33 with #bands= 68 0) Finished k-point number 34 with #bands= 68 0) Finished k-point number 35 with #bands= 68 0) Finished k-point number 36 with #bands= 66 0) Finished k-point number 37 with #bands= 67 0) Finished k-point number 38 with #bands= 67 0) Finished k-point number 39 with #bands= 68 0) Finished k-point number 40 with #bands= 68 0) Finished k-point number 41 with #bands= 68 0) Finished k-point number 42 with #bands= 68 0) Finished k-point number 43 with #bands= 68 0) Finished k-point number 44 with #bands= 68 0) Finished k-point number 45 with #bands= 68 0) Finished k-point number 46 with #bands= 68 0) Finished k-point number 47 with #bands= 68 0) Finished k-point number 48 with #bands= 68 0) Finished k-point number 49 with #bands= 68 0) Finished k-point number 50 with #bands= 68 0) Finished k-point number 51 with #bands= 68 0) Finished k-point number 52 with #bands= 67 0) Finished k-point number 53 with #bands= 67 0) Finished k-point number 54 with #bands= 68 0) Finished k-point number 55 with #bands= 68 0) Finished k-point number 56 with #bands= 69 0) Finished k-point number 57 with #bands= 69 0) Finished k-point number 58 with #bands= 69 0) Finished k-point number 59 with #bands= 69 0) Finished k-point number 60 with #bands= 68 0) Finished k-point number 61 with #bands= 68 0) Finished k-point number 62 with #bands= 68 0) Finished k-point number 63 with #bands= 67 0) Finished k-point number 64 with #bands= 67 0) Finished k-point number 65 with #bands= 68 0) Finished k-point number 66 with #bands= 68 0) Finished k-point number 67 with #bands= 69 0) Finished k-point number 68 with #bands= 69 0) Finished k-point number 69 with #bands= 69 0) Finished k-point number 70 with #bands= 69 0) Finished k-point number 71 with #bands= 69 0) Finished k-point number 72 with #bands= 69 0) Finished k-point number 73 with #bands= 68 0) Finished k-point number 74 with #bands= 68 0) Finished k-point number 75 with #bands= 67 0) Finished k-point number 76 with #bands= 68 0) Finished k-point number 77 with #bands= 68 0) Finished k-point number 78 with #bands= 69 0) Finished k-point number 79 with #bands= 68 0) Finished k-point number 80 with #bands= 68 0) Finished k-point number 81 with #bands= 68 0) Finished k-point number 82 with #bands= 69 0) Finished k-point number 83 with #bands= 68 0) Finished k-point number 84 with #bands= 69 0) Finished k-point number 85 with #bands= 68 0) Finished k-point number 86 with #bands= 67 0) Finished k-point number 87 with #bands= 68 0) Finished k-point number 88 with #bands= 67 0) Finished k-point number 89 with #bands= 69 0) Finished k-point number 90 with #bands= 68 0) Finished k-point number 91 with #bands= 68 0) Finished k-point number 92 with #bands= 68 0) Finished k-point number 93 with #bands= 68 0) Finished k-point number 94 with #bands= 69 0) Finished k-point number 95 with #bands= 68 0) Finished k-point number 96 with #bands= 67 0) Finished k-point number 97 with #bands= 66 0) Finished k-point number 98 with #bands= 67 0) Finished k-point number 99 with #bands= 67 0) Finished k-point number 100 with #bands= 68 0) Finished k-point number 101 with #bands= 69 0) Finished k-point number 102 with #bands= 68 0) Finished k-point number 103 with #bands= 68 0) Finished k-point number 104 with #bands= 68 0) Finished k-point number 105 with #bands= 68 0) Finished k-point number 106 with #bands= 68 0) Finished k-point number 107 with #bands= 68 0) Finished k-point number 108 with #bands= 67 0) Finished k-point number 109 with #bands= 68 0) Finished k-point number 110 with #bands= 68 0) Finished k-point number 111 with #bands= 69 0) Finished k-point number 112 with #bands= 68 0) Finished k-point number 113 with #bands= 68 0) Finished k-point number 114 with #bands= 66 0) Finished k-point number 115 with #bands= 66 0) Finished k-point number 116 with #bands= 66 0) Finished k-point number 117 with #bands= 67 0) Finished k-point number 118 with #bands= 69 0) Finished k-point number 119 with #bands= 69 0) Finished k-point number 120 with #bands= 69 0) Finished k-point number 121 with #bands= 68 0) Finished k-point number 122 with #bands= 68 0) Finished k-point number 123 with #bands= 67 0) Finished k-point number 124 with #bands= 66 0) Finished k-point number 125 with #bands= 66 0) Finished k-point number 126 with #bands= 66 0) Finished k-point number 127 with #bands= 69 0) Finished k-point number 128 with #bands= 69 0) Finished k-point number 129 with #bands= 69 0) Finished k-point number 130 with #bands= 68 0) Finished k-point number 131 with #bands= 68 0) Finished k-point number 132 with #bands= 68 0) Finished k-point number 133 with #bands= 67 0) Finished k-point number 134 with #bands= 66 0) Finished k-point number 135 with #bands= 67 0) Finished k-point number 136 with #bands= 69 0) Finished k-point number 137 with #bands= 68 0) Finished k-point number 138 with #bands= 68 0) Finished k-point number 139 with #bands= 68 0) Finished k-point number 140 with #bands= 69 0) Finished k-point number 141 with #bands= 68 0) Finished k-point number 142 with #bands= 69 0) Finished k-point number 143 with #bands= 68 0) Finished k-point number 144 with #bands= 67 0) Finished k-point number 145 with #bands= 69 0) Finished k-point number 146 with #bands= 69 0) Finished k-point number 147 with #bands= 68 0) Finished k-point number 148 with #bands= 68 0) Finished k-point number 149 with #bands= 68 0) Finished k-point number 150 with #bands= 69 0) Finished k-point number 151 with #bands= 69 0) Finished k-point number 152 with #bands= 68 0) Finished k-point number 153 with #bands= 68 0) Finished k-point number 154 with #bands= 69 0) Finished k-point number 155 with #bands= 69 0) Finished k-point number 156 with #bands= 69 0) Finished k-point number 157 with #bands= 68 0) Finished k-point number 158 with #bands= 68 0) Finished k-point number 159 with #bands= 68 0) Finished k-point number 160 with #bands= 68 0) Finished k-point number 161 with #bands= 68 0) Finished k-point number 162 with #bands= 67 0) Finished k-point number 163 with #bands= 69 0) Finished k-point number 164 with #bands= 67 0) Finished k-point number 165 with #bands= 67 0) Finished k-point number 166 with #bands= 66 0) Finished k-point number 167 with #bands= 66 0) Finished k-point number 168 with #bands= 66 0) Finished k-point number 169 with #bands= 66 0) Finished k-point number 170 with #bands= 69 0) Finished k-point number 171 with #bands= 68 0) Finished k-point number 172 with #bands= 67 0) Finished k-point number 173 with #bands= 67 0) Finished k-point number 174 with #bands= 66 0) Finished k-point number 175 with #bands= 66 0) Finished k-point number 176 with #bands= 66 0) Finished k-point number 177 with #bands= 69 0) Finished k-point number 178 with #bands= 68 0) Finished k-point number 179 with #bands= 67 0) Finished k-point number 180 with #bands= 67 0) Finished k-point number 181 with #bands= 67 0) Finished k-point number 182 with #bands= 67 0) Finished k-point number 183 with #bands= 66 0) Finished k-point number 184 with #bands= 68 0) Finished k-point number 185 with #bands= 68 0) Finished k-point number 186 with #bands= 67 0) Finished k-point number 187 with #bands= 67 0) Finished k-point number 188 with #bands= 68 0) Finished k-point number 189 with #bands= 68 0) Finished k-point number 190 with #bands= 68 0) Finished k-point number 191 with #bands= 69 0) Finished k-point number 192 with #bands= 68 0) Finished k-point number 193 with #bands= 68 0) Finished k-point number 194 with #bands= 69 0) Finished k-point number 195 with #bands= 69 0) Finished k-point number 196 with #bands= 69 0) Finished k-point number 197 with #bands= 68 0) Finished k-point number 198 with #bands= 69 0) Finished k-point number 199 with #bands= 68 0) Finished k-point number 200 with #bands= 68 0) Finished k-point number 201 with #bands= 68 0) Finished k-point number 202 with #bands= 70 0) Finished k-point number 203 with #bands= 70 0) Finished k-point number 204 with #bands= 68 0) Finished k-point number 205 with #bands= 66 0) Finished k-point number 206 with #bands= 66 0) Finished k-point number 207 with #bands= 66 0) Finished k-point number 208 with #bands= 66 0) Finished k-point number 209 with #bands= 66 0) Finished k-point number 210 with #bands= 66 0) Finished k-point number 211 with #bands= 67 0) Finished k-point number 212 with #bands= 67 0) Finished k-point number 213 with #bands= 66 0) Finished k-point number 214 with #bands= 66 0) Finished k-point number 215 with #bands= 67 0) Finished k-point number 216 with #bands= 67 0) Finished k-point number 217 with #bands= 67 0) Finished k-point number 218 with #bands= 67 0) Finished k-point number 219 with #bands= 67 0) Finished k-point number 220 with #bands= 67 0) Finished k-point number 221 with #bands= 67 0) Finished k-point number 222 with #bands= 68 0) Finished k-point number 223 with #bands= 67 0) Finished k-point number 224 with #bands= 67 0) Finished k-point number 225 with #bands= 68 0) Finished k-point number 226 with #bands= 68 0) Finished k-point number 227 with #bands= 69 0) Finished k-point number 228 with #bands= 69 0) Finished k-point number 229 with #bands= 68 0) Finished k-point number 230 with #bands= 68 0) Finished k-point number 231 with #bands= 69 0) Finished k-point number 232 with #bands= 70 0) Finished k-point number 233 with #bands= 70 0) Finished k-point number 234 with #bands= 69 0) Finished k-point number 235 with #bands= 67 0) Finished k-point number 236 with #bands= 67 0) Finished k-point number 237 with #bands= 66 0) Finished k-point number 238 with #bands= 67 0) Finished k-point number 239 with #bands= 67 0) Finished k-point number 240 with #bands= 67 0) Finished k-point number 241 with #bands= 67 0) Finished k-point number 242 with #bands= 67 0) Finished k-point number 243 with #bands= 67 0) Finished k-point number 244 with #bands= 67 0) Finished k-point number 245 with #bands= 67 0) Finished k-point number 246 with #bands= 67 0) Finished k-point number 247 with #bands= 69 0) Finished k-point number 248 with #bands= 69 0) Finished k-point number 249 with #bands= 68 0) Finished k-point number 250 with #bands= 70 0) Finished k-point number 251 with #bands= 70 0) Finished k-point number 252 with #bands= 70 0) Finished k-point number 253 with #bands= 68 0) Finished k-point number 254 with #bands= 67 0) Finished k-point number 255 with #bands= 67 0) Finished k-point number 256 with #bands= 67 0) Finished k-point number 257 with #bands= 68 0) Finished k-point number 258 with #bands= 71 Eimp= -1.48307131101614 -1.59146261732510 -1.38107603797653 -1.40621612818888 -1.41451909167592 -1.48307131101614 -1.59146261732510 -1.38107603797653 -1.40621612818888 -1.41451909167592 -1.48650229922105 -1.59502229659320 -1.38641876530161 -1.40911955250152 -1.41828779450167 -1.48650229922105 -1.59502229659320 -1.38641876530161 -1.40911955250152 -1.41828779450167 final Z due to interstitals= 1.00000000000000 0.999999999999998 1.00000000000000 1.00000000000000 0.999999999999999 1.00000000000000 0.999999999999998 1.00000000000000 1.00000000000000 0.999999999999999 0.999999999999992 0.999999999999997 0.999999999999999 1.00000000000000 0.999999999999993 0.999999999999992 0.999999999999998 0.999999999999999 1.00000000000000 0.999999999999993 DMFT END DmftEnvironment: mpi_prefix.dat exists -- running in parallel mode. /opt/mpich2/intel/10.1/bin/mpiexec -env LD_LIBRARY_PATH /opt/intel/mkl/9.0/lib/em64t -port 30048 -np 1 -machinefile /tmp/260048.1.wsp64_hp/machines case= Ba122 root= /home/yinzping/bin/DMFT2/bin cixs= [1, 2, 3, 4] NOE= 136.0 opening Ba122.scf2 Ef= 7.79646964665 Found DMFT-mu= 7.79651751693 ..... running: /home/yinzping/bin/DMFT2/bin/ssplit.py -n 100 -t 30 -l dn case=Ba122, nom=100, ntail=30, insig=sig.inp, outsig=sig.inp[1-n] s_oo= [27.007316985290249, 27.119162714308967, 27.138336338739609, 27.411485089007058, 27.254949368990726, 25.821942480953968, 26.132609882093504, 25.987710841084652, 25.815029824424645, 25.614447988293492, 25.783852896714425, 26.106028406951005, 25.936375371253998, 25.787140536868566, 25.571066112732399, 27.04697838792535, 27.149529756158575, 27.204713601988566, 27.455615572391636, 27.299478461795395] Edc= [25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75, 25.75] ..... Going over all correlated blocks icix= 1 cols= [6, 7, 8, 9, 10] icix= 2 cols= [6, 7, 8, 9, 10] icix= 3 cols= [16, 17, 18, 19, 20] icix= 4 cols= [16, 17, 18, 19, 20] ..... running: /opt/mpich2/intel/10.1/bin/mpiexec -env LD_LIBRARY_PATH /opt/intel/mkl/9.0/lib/em64t -port 30048 -np 1 -machinefile /tmp/260048.1.wsp64_hp/machines ./dmft dmft1dn.def