ifSP = F ifSO = F -------------------------------- WIENKernel. Jan M. Tomczak, 2010 -------------------------------- Program launched : 25. 4.2011, 15:38 myid, nproc 18 48 external parameters : --------------------- beta [1/eV] = 10.00 T [K] = 1160.45 dw0 [eV] = 0.0050 polarizations : 1 2 3 some internal parameters : --------------------- energy cutoff beyond heavyside [eV] : 2.5000 energy cutoff allowance for KS cutting [eV] : 2.0000 0+ [eV] = 0.0200 will use internal Akw window wmax 5.0000000000000000 Orthorhombic symmetry : response functions diagonal switching to imode=2 mode 2 : computing response tensors number of symmetries 12 fsigname=sig.inp1 case=FeSi fenergy=FeSi.energy fUdmft=Udmft. Using w-mesh with 1 special point (for metals) w0,w1-w0,meshD= 0.0000000000000000 1.00000000000000008E-005 1.00000000000000000 System : FeSi nk = 9020 unit-cell vol/a0^3= 612.0768 optics energy window [eV] : 0.0000 0.0000 ef [eV] = 0.0000000000000000 cutoff energies : 2.500 -2.505 2.498 -913 918 external frequenz interval : 0.000 0.000 0 0 selfenergy input : 1 iwpmin,iwpmax -913 918 parallelisation table : 0 39 1 39 -913 -875 39 39 40 78 -874 -836 78 39 79 117 -835 -797 117 39 118 156 -796 -758 156 39 157 195 -757 -719 195 39 196 234 -718 -680 234 39 235 273 -679 -641 273 39 274 312 -640 -602 312 38 313 350 -601 -564 350 38 351 388 -563 -526 388 38 389 426 -525 -488 426 38 427 464 -487 -450 464 38 465 502 -449 -412 502 38 503 540 -411 -374 540 38 541 578 -373 -336 578 38 579 616 -335 -298 616 38 617 654 -297 -260 654 38 655 692 -259 -222 692 38 693 730 -221 -184 730 38 731 768 -183 -146 768 38 769 806 -145 -108 806 38 807 844 -107 -70 844 38 845 882 -69 -32 882 38 883 920 -31 6 920 38 921 958 7 44 958 38 959 996 45 82 996 38 997 1034 83 120 1034 38 1035 1072 121 158 1072 38 1073 1110 159 196 1110 38 1111 1148 197 234 1148 38 1149 1186 235 272 1186 38 1187 1224 273 310 1224 38 1225 1262 311 348 1262 38 1263 1300 349 386 1300 38 1301 1338 387 424 1338 38 1339 1376 425 462 1376 38 1377 1414 463 500 1414 38 1415 1452 501 538 1452 38 1453 1490 539 576 1490 38 1491 1528 577 614 1528 38 1529 1566 615 652 1566 38 1567 1604 653 690 1604 38 1605 1642 691 728 1642 38 1643 1680 729 766 1680 38 1681 1718 767 804 1718 38 1719 1756 805 842 1756 38 1757 1794 843 880 1794 38 1795 1832 881 918 myid 18 iwTstart,iwTend -221 -184 begin k-loop ------------ frequencies : 18 -221 -184 -1412 1419 902 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -2.439 21.226 dim : 46 1804 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -2.020 21.128 dim : 44 2706 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -42.693 20.945 dim : 45 3608 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -42.690 21.183 dim : 44 4510 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -42.694 20.961 dim : 44 5412 ( 1/ 9020) wtkp= 12.00000 cutted KS range : -42.689 20.846 dim : 43 6314 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -42.690 20.287 dim : 43 7216 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -42.690 21.185 dim : 44 8118 ( 1/ 9020) wtkp= 24.00000 cutted KS range : -42.690 21.086 dim : 44 9020 ( 1/ 9020) wtkp= 1.00000 cutted KS range : -42.694 20.625 dim : 49 done phi. now gathering data finished 25. 4.2011, 17:30