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$ x kgen NUMBER OF K-POINTS IN WHOLE CELL: (0 allows to specify 3 divisions of G) 10000 length of reciprocal lattice vectors: 1.342 1.342 1.342 21.544 21.544 21.544 286 k-points generated, ndiv= 21 21 21 KGEN ENDS 0.137u 0.004s 0:06.64 1.9% 0+0k 0+1376io 0pf+0w
$ x lapw1 -p
$ x lapw1 -up -p $ x lapw1 -dn -p
$ x qtl
$ grep "tot" TiC.qtl JATOM 1 MULT= 1 ISPLIT= 5 tot,s,p,d,d-eg,d-t2g, JATOM 2 MULT= 1 ISPLIT= 5 tot,s,p,
$ configure_int_lapw -b total 1 tot,d,d-eg,d-t2g 2 tot,s,p end
Title -1.000 0.00250 1.200 0.003 #Emin, DE, Emax, Gauss-Broad 8 #Number of DOS 0 1 total-DOS 1 1 tot-Ti 1 4 d-Ti 1 5 d-eg-Ti 1 6 d-t2g-Ti 2 1 tot-C 2 2 s-C 2 3 p-C
$ x tetra -p