NRG Ljubljana 2.4.3.32 - (c) Rok Zitko Timestamp: Mon Nov 13 12:55:52 2017 Compiled on Jan 16 2019 at 23:24:35 Compiled-in symmetry types: ANYJ DBLISOSZ DBLSU2 ISO ISO2 ISO2LR ISOLR ISOSZ ISOSZLR NONE P PP QJ QS QSC3 QSLR QST QSTZ QSZ QSZLR QSZTZ SL SL3 SPSU2 SPSU2C3 SPSU2LR SPSU2T SPU1 SPU1LR SU2 U1 No MPI: single node calculation. workdir=. substeps=0 Ninit=0 Lambda=3 strategy=kept lastall=1 lastalloverride=0 z=0.75 discretization=Z band=asymode bandrescale=10 betabar=1 T=1e-08 keep=10000 keepenergy=8 keepmin=200 log= logall=0 logenumber=10 smooth=old alpha=0.3 omega0=-1 omega0_ratio=1 brcut=0 loggauss_b=0.3 gauss_b=0.1 limitLL=0 eta=0 finite=0 bins=300 accumulation=0 linstep=0 discard_trim=1e-16 discard_immediately=1e-16 NN1=0 NN2even=1 NN2avg=0 NNtanh=0 goodE=2 savebins=1 broaden=0 broaden_max=10 broaden_min=1e-06 broaden_min_ratio=3 broaden_ratio=1.01 dumpenergies=0 dumpannotated=0 dumpscaled=1 dumpabs=0 dumpprecision=8 dumpgroups=1 grouptol=1e-06 dumpdiagonal=0 ops=A_d self_d n_d specs= specd=A_d-A_d self_d-A_d spect= specq= specot= reim=0 specgt= gtp=0.7 speci1t= speci2t= specchit= chitp=1 chitp_ratio=-999 dm=1 T0opt=-1 dmnrg=0 cfs=0 cfsgt=0 cfsls=0 fdm=1 fdmgt=0 fdmls=0 fdmexpv=0 fdmexpvn=0 cfsold=0 fdmold=0 width_td=12 width_custom=12 prec_td=6 prec_custom=6 prec_xy=6 safeguard=1e-05 safeguardmax=200 fixeps=1e-15 diag=dsyev diagratio=1 dsyevrlimit=100 zheevrlimit=100 restart=1 restartfactor=2 checkdiag=0 checkrho=0 calc0=1 tdht=0 spin=2 tri=old preccpp=2000 checksumrules=0 globalB=0 globalBx=0 polarized=0 pol2x2=0 mpi=0 noimag=1 dumpsubspaces=0 done=1 resume=0 forcestop=-1 stopafter= removefiles=1 dump_f=0 rungs=0 >> Input file for NRG Ljubljana, Rok Zitko, rok.zitko@ijs.si, 2005-2015 SYMMETRY TYPE: QS invdim=2 0 Q additive 1 SS additive I=(0 1) [0 (additive), 1 (additive)] singlet QNs=(0 1) mult=1 >> Using sneg version 1.250 V8 >> Number of channels, impurities, chain sites, subspaces: channels=1 impurities=1 Nmax=38 subspaces=6 Reading <||||> (e) Reading <||n_d||> (s) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||||> (z) length_coef_table=38 Nmax=38 Number of invariant subspaces: 6 (-2 1) 1 states 0.1169726685846898 (-1 2) 2 states 0.02970738323911614 0.1319451997589454 (0 1) 3 states 0 0.1169726685846898 0.1616525829980616 (0 3) 1 states 0.04467991441337176 (1 2) 2 states 0.02970738323911619 0.1319451997589454 (2 1) 1 states 0.1169726685846899 Number of states (multiplicity taken into account): 16 Computing the following operators: s=[] p=[] g=[] d=[A_d self_d ] v=[] t=[] q=[] ot=[] Computing the following spectra: Before NRG iteration (N=-1) =1 ***** [NRG] Iteration 1/38 (scale 7.9862812782237) ***** [1] xi(0)=1.709618992241652 xi_scaled(0)=0.2140694689658994 zeta(1)=2.040048487935467e-14 Stats: nr=10 min=1 max=8 Emax=1.004734485347385 nrkept=35 nrkeptmult=64 Total energy=-4.51204610495777 Egs=-0.3623719992099984 Kept: 35 out of 35, ratio=1 =0.9999999999999997 Memory used: 1 MB Time elapsed: 0 s ***** [NRG] Iteration 2/38 (scale 4.610881645806522) ***** [1] xi(1)=2.529963863529932 xi_scaled(1)=0.5486941669454625 zeta(2)=2.811434662587854e-14 Stats: nr=15 min=1 max=20 Emax=3.077548278099192 nrkept=126 nrkeptmult=256 Total energy=-7.595105434785516 Egs=-0.6686485506804776 Kept: 126 out of 126, ratio=1 =0.9999999999999996 Memory used: 1 MB Time elapsed: 0 s ***** [NRG] Iteration 3/38 (scale 2.6620937594079002) ***** [1] xi(2)=3.858077692489605 xi_scaled(2)=1.449264391554606 zeta(3)=1.354840040985228e-13 Stats: nr=21 min=1 max=75 Emax=8.178329494343659 nrkept=439 nrkeptmult=984 Total energy=-13.33354997106943 Egs=-2.155613233382228 Kept: 439 out of 462, ratio=0.95 =1.000000000000001 Memory used: 3 MB Time elapsed: 0 s ***** [NRG] Iteration 4/38 (scale 1.536960548602174) ***** [1] xi(3)=7.10688759600631 xi_scaled(3)=4.623988301111464 zeta(4)=-1.459216706336853e-13 Stats: nr=28 min=1 max=197 Safeguard: keep additional 2 states Emax=8.055068687588284 nrkept=202 nrkeptmult=452 Total energy=-23.37944455279563 Egs=-6.536208486849374 Kept: 202 out of 1634, ratio=0.124 =0.999999999999998 Memory used: 7 MB Time elapsed: 0 s ***** [NRG] Iteration 5/38 (scale 0.88736458646930017) ***** [1] xi(4)=3.417795295599403 xi_scaled(4)=3.851624628382267 zeta(5)=-4.783633269940538e-14 Stats: nr=27 min=1 max=113 Emax=9.856704663531982 nrkept=200 nrkeptmult=440 Total energy=-26.39208753924972 Egs=-3.395045320031277 Kept: 200 out of 754, ratio=0.265 =0.9999999999999957 Memory used: 7 MB Time elapsed: 0 s ***** [NRG] Iteration 6/38 (scale 0.51232018286739134) ***** [1] xi(5)=0.7612179166641477 xi_scaled(5)=1.485824572445511 zeta(6)=1.815418409356862e-14 Stats: nr=25 min=2 max=94 Emax=10.29922614216378 nrkept=200 nrkeptmult=448 Total energy=-27.01854409023056 Egs=-1.222783274854883 Kept: 200 out of 744, ratio=0.269 =0.9999999999999958 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 7/38 (scale 0.2957881954897667) ***** [1] xi(6)=0.2760642670600473 xi_scaled(6)=0.9333173915305834 zeta(7)=5.958343883695678e-15 Stats: nr=27 min=1 max=111 Emax=10.32643115368175 nrkept=200 nrkeptmult=462 Total energy=-27.33457581800736 Egs=-1.068439283905565 Kept: 200 out of 746, ratio=0.268 =0.9999999999999958 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 8/38 (scale 0.17077339428913046) ***** [1] xi(7)=0.2555293847039996 xi_scaled(7)=1.496306762348307 zeta(8)=-1.080999222467889e-14 Stats: nr=26 min=1 max=91 Safeguard: keep additional 3 states Emax=11.08608141164083 nrkept=203 nrkeptmult=491 Total energy=-27.66460685117927 Egs=-1.932567040350241 Kept: 203 out of 748, ratio=0.271 =0.9999999999999969 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 9/38 (scale 0.098596065163255572) ***** [1] xi(8)=0.1428045271722511 xi_scaled(8)=1.448379577174759 zeta(9)=-3.20816242107186e-15 Stats: nr=29 min=1 max=102 Safeguard: keep additional 1 states Emax=12.33926167078083 nrkept=201 nrkeptmult=462 Total energy=-27.79434275593301 Egs=-1.315832478090475 Kept: 201 out of 763, ratio=0.263 =0.9999999999999967 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 10/38 (scale 0.056924464763043484) ***** [1] xi(9)=0.07675789446976627 xi_scaled(9)=1.348416621733421 zeta(10)=-5.233434078420483e-16 Stats: nr=26 min=1 max=94 Emax=12.46430494246234 nrkept=200 nrkeptmult=498 Total energy=-27.89608216012966 Egs=-1.787270282121346 Kept: 200 out of 750, ratio=0.267 =0.9999999999999969 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 11/38 (scale 0.032865355054418524) ***** [1] xi(10)=0.04109484757041952 xi_scaled(10)=1.250400231562221 zeta(11)=-1.564659337196033e-16 Stats: nr=31 min=1 max=99 Emax=13.01304543493218 nrkept=200 nrkeptmult=470 Total energy=-27.92784896454397 Egs=-0.9665742044081073 Kept: 200 out of 755, ratio=0.265 =0.9999999999999978 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 12/38 (scale 0.01897482158768116) ***** [1] xi(11)=0.02323256866975145 xi_scaled(11)=1.224389307820133 zeta(12)=-4.695301409381716e-17 Stats: nr=26 min=1 max=91 Safeguard: keep additional 1 states Emax=13.38479280066348 nrkept=201 nrkeptmult=481 Total energy=-27.96335000950861 Egs=-1.870955402694731 Kept: 201 out of 748, ratio=0.269 =0.9999999999999961 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 13/38 (scale 0.01095511835147284) ***** [1] xi(12)=0.01316900562698265 xi_scaled(12)=1.20208702493955 zeta(13)=-2.167709460496875e-17 Stats: nr=29 min=1 max=104 Safeguard: keep additional 1 states Emax=13.98649584734511 nrkept=201 nrkeptmult=466 Total energy=-27.97237339206051 Egs=-0.8236681943913456 Kept: 201 out of 757, ratio=0.266 =0.9999999999999964 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 14/38 (scale 0.0063249405292270539) ***** [1] xi(13)=0.007563665811161738 xi_scaled(13)=1.195847735834137 zeta(14)=-7.125295477717216e-18 Stats: nr=26 min=1 max=94 Safeguard: keep additional 4 states Emax=14.823694193413 nrkept=204 nrkeptmult=468 Total energy=-27.98483870863604 Egs=-1.970819570226694 Kept: 204 out of 752, ratio=0.271 =0.9999999999999981 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 15/38 (scale 0.0036517061171576137) ***** [1] xi(14)=0.004350654750968049 xi_scaled(14)=1.191403308860593 zeta(15)=-2.956360018697936e-18 Stats: nr=29 min=1 max=109 Emax=14.64872060087044 nrkept=200 nrkeptmult=440 Total energy=-27.98765850366332 Egs=-0.7721856405790227 Kept: 200 out of 762, ratio=0.262 =0.9999999999999971 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 16/38 (scale 0.0021083135097423513) ***** [1] xi(15)=0.00250875042330097 xi_scaled(15)=1.189932337723129 zeta(16)=-1.601230477956646e-18 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=15.63847760282193 nrkept=201 nrkeptmult=449 Total energy=-27.99191377198389 Egs=-2.018328062171077 Kept: 201 out of 744, ratio=0.27 =0.9999999999999974 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 17/38 (scale 0.0012172353723858712) ***** [1] xi(16)=0.001447475449594944 xi_scaled(16)=1.189150005358278 zeta(17)=-2.550649407137018e-19 Stats: nr=27 min=1 max=112 Emax=14.4825981158918 nrkept=200 nrkeptmult=440 Total energy=-27.99283310898989 Egs=-0.7552664232890911 Kept: 200 out of 750, ratio=0.267 =0.9999999999999979 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 18/38 (scale 0.0007027711699141171) ***** [1] xi(17)=0.0008355392717993994 xi_scaled(17)=1.188920814582515 zeta(18)=-1.324439236648742e-19 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.00113802898028 nrkept=201 nrkeptmult=449 Total energy=-27.99426419284137 Egs=-2.03634399467712 Kept: 201 out of 744, ratio=0.27 =0.999999999999997 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 19/38 (scale 0.00040574512412862372) ***** [1] xi(18)=0.0004823450899319956 xi_scaled(18)=1.188788382775708 zeta(19)=2.027933532760256e-20 Stats: nr=27 min=1 max=112 Emax=14.4095819404067 nrkept=200 nrkeptmult=440 Total energy=-27.99456845384274 Egs=-0.749882089197032 Kept: 200 out of 750, ratio=0.267 =0.9999999999999984 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 20/38 (scale 0.00023425705663803904) ***** [1] xi(19)=0.0002784759394352801 xi_scaled(19)=1.188762223140051 zeta(20)=-8.108439748874658e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.11172371369626 nrkept=201 nrkeptmult=449 Total energy=-27.99504695214087 Egs=-2.042620636479166 Kept: 201 out of 744, ratio=0.27 =0.9999999999999989 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 21/38 (scale 0.00013524837470954126) ***** [1] xi(20)=0.0001607745155822816 xi_scaled(20)=1.188735287411476 zeta(21)=1.361870187336367e-20 Stats: nr=27 min=1 max=112 Emax=14.38314046474655 nrkept=200 nrkeptmult=440 Total energy=-27.9951481374524 Egs=-0.7481443806260105 Kept: 200 out of 750, ratio=0.267 =0.9999999999999978 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 22/38 (scale 7.8085685546013005e-05) ***** [1] xi(21)=9.282299226344949e-05 xi_scaled(21)=1.188732500898034 zeta(22)=1.719373303601682e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.14683635988193 nrkept=201 nrkeptmult=449 Total energy=-27.99530780198974 Egs=-2.044735039734817 Kept: 201 out of 744, ratio=0.27 =0.9999999999999984 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 23/38 (scale 4.5082791569847077e-05) ***** [1] xi(22)=5.359105934755716e-05 xi_scaled(22)=1.188725397905499 zeta(23)=4.068311582137656e-21 Stats: nr=27 min=1 max=112 Emax=14.3740072880059 nrkept=200 nrkeptmult=440 Total energy=-27.99534150477681 Egs=-0.7475754250792049 Kept: 200 out of 750, ratio=0.267 =1 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 24/38 (scale 2.6028561848671004e-05) ***** [1] xi(23)=3.094080605907517e-05 xi_scaled(23)=1.188725148894655 zeta(24)=1.061633955721475e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.1582572802041 nrkept=201 nrkeptmult=449 Total energy=-27.99539474461867 Egs=-2.045439243797416 Kept: 201 out of 744, ratio=0.27 =0.9999999999999993 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 25/38 (scale 1.5027597189949027e-05) ***** [1] xi(24)=1.786364903078045e-05 xi_scaled(24)=1.188722907926243 zeta(25)=8.092657872946533e-22 Stats: nr=27 min=1 max=112 Emax=14.37086142203829 nrkept=200 nrkeptmult=440 Total energy=-27.99540597606595 Egs=-0.7473880977054081 Kept: 200 out of 750, ratio=0.267 =0.9999999999999988 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 26/38 (scale 8.6761872828903336e-06) ***** [1] xi(25)=1.031358377325593e-05 xi_scaled(25)=1.188723045846946 zeta(26)=5.79974894047337e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16158179319961 nrkept=201 nrkeptmult=443 Total energy=-27.99542372470847 Egs=-2.045673052449194 Kept: 201 out of 744, ratio=0.27 =0.9999999999999993 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 27/38 (scale 5.009199063316343e-06) ***** [1] xi(26)=5.954545605095626e-06 xi_scaled(26)=1.188722095055535 zeta(27)=-1.875110559181167e-22 Stats: nr=27 min=1 max=112 Emax=14.36977780750617 nrkept=200 nrkeptmult=440 Total energy=-27.99542746821419 Egs=-0.7473262020404278 Kept: 200 out of 747, ratio=0.268 =0.9999999999999992 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 28/38 (scale 2.8920624276301116e-06) ***** [1] xi(27)=3.437859913571386e-06 xi_scaled(27)=1.188722581064243 zeta(28)=6.821454689372371e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16297253465988 nrkept=201 nrkeptmult=443 Total energy=-27.9954333846537 Egs=-2.045750970898417 Kept: 201 out of 744, ratio=0.27 =0.9999999999999989 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 29/38 (scale 1.6697330211054477e-06) ***** [1] xi(28)=1.984847894184252e-06 xi_scaled(28)=1.188721711253085 zeta(29)=-3.351058977830918e-22 Stats: nr=27 min=1 max=112 Emax=14.36940533018772 nrkept=200 nrkeptmult=440 Total energy=-27.99543463245439 Egs=-0.7473055093903084 Kept: 200 out of 747, ratio=0.268 =0.999999999999998 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 30/38 (scale 9.6402080921003706e-07) ***** [1] xi(29)=1.145953453792713e-06 xi_scaled(29)=1.188722735904176 zeta(30)=2.198748415421164e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16349221133521 nrkept=201 nrkeptmult=443 Total energy=-27.99543660462646 Egs=-2.045777483331176 Kept: 201 out of 744, ratio=0.27 =0.9999999999999987 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 31/38 (scale 5.5657767370181582e-07) ***** [1] xi(30)=6.616163316151282e-07 xi_scaled(30)=1.18872237043699 zeta(31)=-1.523742249367509e-22 Stats: nr=27 min=1 max=112 Emax=14.36927946775393 nrkept=200 nrkeptmult=440 Total energy=-27.99543702055659 Egs=-0.7472993587045055 Kept: 200 out of 747, ratio=0.268 =0.9999999999999991 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 32/38 (scale 3.2134026973667913e-07) ***** [1] xi(31)=3.819842245275799e-07 xi_scaled(31)=1.188721926575201 zeta(32)=-9.687608491494415e-23 Stats: nr=25 min=2 max=94 Safeguard: keep additional 2 states Emax=16.16367558428173 nrkept=202 nrkeptmult=446 Total energy=-27.99543767794955 Egs=-2.045784538918595 Kept: 202 out of 744, ratio=0.272 =1 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 33/38 (scale 1.8552589123393861e-07) ***** [1] xi(32)=2.205386791134951e-07 xi_scaled(32)=1.188721841715382 zeta(33)=-3.429841855138418e-23 Stats: nr=27 min=1 max=113 Emax=14.3692399104601 nrkept=200 nrkeptmult=440 Total energy=-27.99543781659249 Egs=-0.7472969905390934 Kept: 200 out of 751, ratio=0.266 =0.9999999999999991 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 34/38 (scale 1.0711342324555968e-07) ***** [1] xi(33)=1.273280659870069e-07 xi_scaled(33)=1.188721843900972 zeta(34)=-1.145886704580178e-23 Stats: nr=25 min=2 max=94 Safeguard: keep additional 20 states Emax=16.16376528537022 nrkept=220 nrkeptmult=486 Total energy=-27.99543803572375 Egs=-2.045787169075218 Kept: 220 out of 744, ratio=0.296 =0.9999999999999991 Memory used: 8 MB Time elapsed: 1 s ***** [NRG] Iteration 35/38 (scale 6.1841963744646202e-08) ***** [1] xi(34)=7.351289062754321e-08 xi_scaled(34)=1.188721802740415 zeta(35)=-3.819731089253127e-24 Stats: nr=29 min=1 max=119 Emax=14.36921816961268 nrkept=200 nrkeptmult=440 Total energy=-27.99543808193803 Egs=-0.7472962955106571 Kept: 200 out of 816, ratio=0.245 =1 Memory used: 8 MB Time elapsed: 1 s ***** [NRG] Iteration 36/38 (scale 3.5704474415186565e-08) ***** [1] xi(35)=4.244268751954171e-08 xi_scaled(35)=1.188721811893949 zeta(36)=-1.273243940986564e-24 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16376135694 nrkept=225 nrkeptmult=491 Total energy=-27.99543815498181 Egs=-2.045788014818221 Kept: 225 out of 744, ratio=0.302 =0.9999999999999991 Memory used: 8 MB Time elapsed: 1 s ***** [NRG] Iteration 37/38 (scale 2.0613987914882067e-08) ***** [1] xi(36)=2.45042954098163e-08 xi_scaled(36)=1.188721731622131 zeta(37)=-4.244145843705585e-25 Stats: nr=29 min=1 max=120 Emax=14.36921137417299 nrkept=200 nrkeptmult=440 Total energy=-27.99543817038656 Egs=-0.7472960074616941 Kept: 200 out of 831, ratio=0.241 =1 Memory used: 8 MB Time elapsed: 1 s ***** [NRG] Iteration 38/38 (scale 1.1901491471728852e-08) ***** [1] xi(37)=1.414756166524097e-08 xi_scaled(37)=1.188721741207604 zeta(38)=-1.41471543476728e-25 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16375706814691 nrkept=744 nrkeptmult=1760 Total energy=-27.99543819473449 Egs=-2.045788207952278 Kept: 744 out of 744, ratio=1 =0.9999999999999977 Memory used: 8 MB Time elapsed: 1 s ** Iteration completed. Total energy: -27.99543819473449 TKW=0.02684021746880964 Grand canonical Z= 3.238373019567805 Zft (last shell)= 3.238373227372964 Calculating density matrices. [DM] 37 [DM] 36 [DM] 35 [DM] 34 [DM] 33 [DM] 32 [DM] 31 [DM] 30 [DM] 29 [DM] 28 [DM] 27 [DM] 26 [DM] 25 [DM] 24 [DM] 23 [DM] 22 [DM] 21 [DM] 20 [DM] 19 [DM] 18 [DM] 17 [DM] 16 [DM] 15 [DM] 14 [DM] 13 [DM] 12 [DM] 11 [DM] 10 [DM] 9 [DM] 8 [DM] 7 [DM] 6 [DM] 5 [DM] 4 [DM] 3 [DM] 2 [DM] 1 Calculating full density matrices. [FDM] 37 [FDM] 36 [FDM] 35 [FDM] 34 [FDM] 33 [FDM] 32 [FDM] 31 [FDM] 30 [FDM] 29 [FDM] 28 [FDM] 27 [FDM] 26 [FDM] 25 [FDM] 24 [FDM] 23 [FDM] 22 [FDM] 21 [FDM] 20 [FDM] 19 [FDM] 18 [FDM] 17 [FDM] 16 [FDM] 15 [FDM] 14 [FDM] 13 [FDM] 12 [FDM] 11 [FDM] 10 [FDM] 9 [FDM] 8 [FDM] 7 [FDM] 6 [FDM] 5 [FDM] 4 [FDM] 3 [FDM] 2 [FDM] 1 >> Input file for NRG Ljubljana, Rok Zitko, rok.zitko@ijs.si, 2005-2015 SYMMETRY TYPE: QS >> Using sneg version 1.250 V8 >> Number of channels, impurities, chain sites, subspaces: channels=1 impurities=1 Nmax=38 subspaces=6 Reading <||||> (e) Reading <||n_d||> (s) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||||> (z) Number of invariant subspaces: 6 (-2 1) 1 states 0.1169726685846898 (-1 2) 2 states 0.02970738323911614 0.1319451997589454 (0 1) 3 states 0 0.1169726685846898 0.1616525829980616 (0 3) 1 states 0.04467991441337176 (1 2) 2 states 0.02970738323911619 0.1319451997589454 (2 1) 1 states 0.1169726685846899 Number of states (multiplicity taken into account): 16 Computing the following operators: s=[] p=[] g=[] d=[A_d self_d ] v=[] t=[] q=[] ot=[] Computing the following spectra: Spectrum: A_d-A_d FDM Spectrum: self_d-A_d FDM ***** [DM] Iteration 1/38 (scale 7.9862812782237) ***** [1] xi(0)=1.709618992241652 xi_scaled(0)=0.2140694689658994 zeta(1)=2.040048487935467e-14 Stats: nr=10 min=1 max=8 Emax=1.004734485347385 nrkept=35 nrkeptmult=64 Kept: 35 out of 35, ratio=1 Memory used: 11 MB Time elapsed: 1 s ***** [DM] Iteration 2/38 (scale 4.610881645806522) ***** [1] xi(1)=2.529963863529932 xi_scaled(1)=0.5486941669454625 zeta(2)=2.811434662587854e-14 Stats: nr=15 min=1 max=20 Emax=3.077548278099192 nrkept=126 nrkeptmult=256 Kept: 126 out of 126, ratio=1 Memory used: 11 MB Time elapsed: 1 s ***** [DM] Iteration 3/38 (scale 2.6620937594079002) ***** [1] xi(2)=3.858077692489605 xi_scaled(2)=1.449264391554606 zeta(3)=1.354840040985228e-13 Stats: nr=21 min=1 max=75 Emax=8.178329494343659 nrkept=439 nrkeptmult=984 Kept: 439 out of 462, ratio=0.95 Memory used: 11 MB Time elapsed: 1 s ***** [DM] Iteration 4/38 (scale 1.536960548602174) ***** [1] xi(3)=7.10688759600631 xi_scaled(3)=4.623988301111464 zeta(4)=-1.459216706336853e-13 Stats: nr=28 min=1 max=197 Safeguard: keep additional 2 states Emax=8.055068687588284 nrkept=202 nrkeptmult=452 Kept: 202 out of 1634, ratio=0.124 Memory used: 13 MB Time elapsed: 1 s ***** [DM] Iteration 5/38 (scale 0.88736458646930017) ***** [1] xi(4)=3.417795295599403 xi_scaled(4)=3.851624628382267 zeta(5)=-4.783633269940538e-14 Stats: nr=27 min=1 max=113 Emax=9.856704663531982 nrkept=200 nrkeptmult=440 Kept: 200 out of 754, ratio=0.265 Memory used: 13 MB Time elapsed: 1 s ***** [DM] Iteration 6/38 (scale 0.51232018286739134) ***** [1] xi(5)=0.7612179166641477 xi_scaled(5)=1.485824572445511 zeta(6)=1.815418409356862e-14 Stats: nr=25 min=2 max=94 Emax=10.29922614216378 nrkept=200 nrkeptmult=448 Kept: 200 out of 744, ratio=0.269 Memory used: 13 MB Time elapsed: 2 s ***** [DM] Iteration 7/38 (scale 0.2957881954897667) ***** [1] xi(6)=0.2760642670600473 xi_scaled(6)=0.9333173915305834 zeta(7)=5.958343883695678e-15 Stats: nr=27 min=1 max=111 Emax=10.32643115368175 nrkept=200 nrkeptmult=462 Kept: 200 out of 746, ratio=0.268 Memory used: 14 MB Time elapsed: 2 s ***** [DM] Iteration 8/38 (scale 0.17077339428913046) ***** [1] xi(7)=0.2555293847039996 xi_scaled(7)=1.496306762348307 zeta(8)=-1.080999222467889e-14 Stats: nr=26 min=1 max=91 Safeguard: keep additional 3 states Emax=11.08608141164083 nrkept=203 nrkeptmult=491 Kept: 203 out of 748, ratio=0.271 Memory used: 14 MB Time elapsed: 2 s ***** [DM] Iteration 9/38 (scale 0.098596065163255572) ***** [1] xi(8)=0.1428045271722511 xi_scaled(8)=1.448379577174759 zeta(9)=-3.20816242107186e-15 Stats: nr=29 min=1 max=102 Safeguard: keep additional 1 states Emax=12.33926167078083 nrkept=201 nrkeptmult=462 Kept: 201 out of 763, ratio=0.263 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 10/38 (scale 0.056924464763043484) ***** [1] xi(9)=0.07675789446976627 xi_scaled(9)=1.348416621733421 zeta(10)=-5.233434078420483e-16 Stats: nr=26 min=1 max=94 Emax=12.46430494246234 nrkept=200 nrkeptmult=498 Kept: 200 out of 750, ratio=0.267 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 11/38 (scale 0.032865355054418524) ***** [1] xi(10)=0.04109484757041952 xi_scaled(10)=1.250400231562221 zeta(11)=-1.564659337196033e-16 Stats: nr=31 min=1 max=99 Emax=13.01304543493218 nrkept=200 nrkeptmult=470 Kept: 200 out of 755, ratio=0.265 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 12/38 (scale 0.01897482158768116) ***** [1] xi(11)=0.02323256866975145 xi_scaled(11)=1.224389307820133 zeta(12)=-4.695301409381716e-17 Stats: nr=26 min=1 max=91 Safeguard: keep additional 1 states Emax=13.38479280066348 nrkept=201 nrkeptmult=481 Kept: 201 out of 748, ratio=0.269 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 13/38 (scale 0.01095511835147284) ***** [1] xi(12)=0.01316900562698265 xi_scaled(12)=1.20208702493955 zeta(13)=-2.167709460496875e-17 Stats: nr=29 min=1 max=104 Safeguard: keep additional 1 states Emax=13.98649584734511 nrkept=201 nrkeptmult=466 Kept: 201 out of 757, ratio=0.266 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 14/38 (scale 0.0063249405292270539) ***** [1] xi(13)=0.007563665811161738 xi_scaled(13)=1.195847735834137 zeta(14)=-7.125295477717216e-18 Stats: nr=26 min=1 max=94 Safeguard: keep additional 4 states Emax=14.823694193413 nrkept=204 nrkeptmult=468 Kept: 204 out of 752, ratio=0.271 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 15/38 (scale 0.0036517061171576137) ***** [1] xi(14)=0.004350654750968049 xi_scaled(14)=1.191403308860593 zeta(15)=-2.956360018697936e-18 Stats: nr=29 min=1 max=109 Emax=14.64872060087044 nrkept=200 nrkeptmult=440 Kept: 200 out of 762, ratio=0.262 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 16/38 (scale 0.0021083135097423513) ***** [1] xi(15)=0.00250875042330097 xi_scaled(15)=1.189932337723129 zeta(16)=-1.601230477956646e-18 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=15.63847760282193 nrkept=201 nrkeptmult=449 Kept: 201 out of 744, ratio=0.27 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 17/38 (scale 0.0012172353723858712) ***** [1] xi(16)=0.001447475449594944 xi_scaled(16)=1.189150005358278 zeta(17)=-2.550649407137018e-19 Stats: nr=27 min=1 max=112 Emax=14.4825981158918 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 18/38 (scale 0.0007027711699141171) ***** [1] xi(17)=0.0008355392717993994 xi_scaled(17)=1.188920814582515 zeta(18)=-1.324439236648742e-19 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.00113802898028 nrkept=201 nrkeptmult=449 Kept: 201 out of 744, ratio=0.27 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 19/38 (scale 0.00040574512412862372) ***** [1] xi(18)=0.0004823450899319956 xi_scaled(18)=1.188788382775708 zeta(19)=2.027933532760256e-20 Stats: nr=27 min=1 max=112 Emax=14.4095819404067 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 20/38 (scale 0.00023425705663803904) ***** [1] xi(19)=0.0002784759394352801 xi_scaled(19)=1.188762223140051 zeta(20)=-8.108439748874658e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.11172371369626 nrkept=201 nrkeptmult=449 Kept: 201 out of 744, ratio=0.27 Memory used: 17 MB Time elapsed: 2 s ***** [DM] Iteration 21/38 (scale 0.00013524837470954126) ***** [1] xi(20)=0.0001607745155822816 xi_scaled(20)=1.188735287411476 zeta(21)=1.361870187336367e-20 Stats: nr=27 min=1 max=112 Emax=14.38314046474655 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 17 MB Time elapsed: 2 s ***** [DM] Iteration 22/38 (scale 7.8085685546013005e-05) ***** [1] xi(21)=9.282299226344949e-05 xi_scaled(21)=1.188732500898034 zeta(22)=1.719373303601682e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.14683635988193 nrkept=201 nrkeptmult=449 Kept: 201 out of 744, ratio=0.27 Memory used: 17 MB Time elapsed: 2 s ***** [DM] Iteration 23/38 (scale 4.5082791569847077e-05) ***** [1] xi(22)=5.359105934755716e-05 xi_scaled(22)=1.188725397905499 zeta(23)=4.068311582137656e-21 Stats: nr=27 min=1 max=112 Emax=14.3740072880059 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 17 MB Time elapsed: 2 s ***** [DM] Iteration 24/38 (scale 2.6028561848671004e-05) ***** [1] xi(23)=3.094080605907517e-05 xi_scaled(23)=1.188725148894655 zeta(24)=1.061633955721475e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.1582572802041 nrkept=201 nrkeptmult=449 Kept: 201 out of 744, ratio=0.27 Memory used: 18 MB Time elapsed: 2 s ***** [DM] Iteration 25/38 (scale 1.5027597189949027e-05) ***** [1] xi(24)=1.786364903078045e-05 xi_scaled(24)=1.188722907926243 zeta(25)=8.092657872946533e-22 Stats: nr=27 min=1 max=112 Emax=14.37086142203829 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 18 MB Time elapsed: 2 s ***** [DM] Iteration 26/38 (scale 8.6761872828903336e-06) ***** [1] xi(25)=1.031358377325593e-05 xi_scaled(25)=1.188723045846946 zeta(26)=5.79974894047337e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16158179319961 nrkept=201 nrkeptmult=443 Kept: 201 out of 744, ratio=0.27 Memory used: 19 MB Time elapsed: 2 s ***** [DM] Iteration 27/38 (scale 5.009199063316343e-06) ***** [1] xi(26)=5.954545605095626e-06 xi_scaled(26)=1.188722095055535 zeta(27)=-1.875110559181167e-22 Stats: nr=27 min=1 max=112 Emax=14.36977780750617 nrkept=200 nrkeptmult=440 Kept: 200 out of 747, ratio=0.268 Memory used: 19 MB Time elapsed: 2 s ***** [DM] Iteration 28/38 (scale 2.8920624276301116e-06) ***** [1] xi(27)=3.437859913571386e-06 xi_scaled(27)=1.188722581064243 zeta(28)=6.821454689372371e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16297253465988 nrkept=201 nrkeptmult=443 Kept: 201 out of 744, ratio=0.27 Memory used: 19 MB Time elapsed: 2 s ***** [DM] Iteration 29/38 (scale 1.6697330211054477e-06) ***** [1] xi(28)=1.984847894184252e-06 xi_scaled(28)=1.188721711253085 zeta(29)=-3.351058977830918e-22 Stats: nr=27 min=1 max=112 Emax=14.36940533018772 nrkept=200 nrkeptmult=440 Kept: 200 out of 747, ratio=0.268 Memory used: 19 MB Time elapsed: 2 s ***** [DM] Iteration 30/38 (scale 9.6402080921003706e-07) ***** [1] xi(29)=1.145953453792713e-06 xi_scaled(29)=1.188722735904176 zeta(30)=2.198748415421164e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16349221133521 nrkept=201 nrkeptmult=443 Kept: 201 out of 744, ratio=0.27 Memory used: 19 MB Time elapsed: 2 s ***** [DM] Iteration 31/38 (scale 5.5657767370181582e-07) ***** [1] xi(30)=6.616163316151282e-07 xi_scaled(30)=1.18872237043699 zeta(31)=-1.523742249367509e-22 Stats: nr=27 min=1 max=112 Emax=14.36927946775393 nrkept=200 nrkeptmult=440 Kept: 200 out of 747, ratio=0.268 Memory used: 20 MB Time elapsed: 2 s ***** [DM] Iteration 32/38 (scale 3.2134026973667913e-07) ***** [1] xi(31)=3.819842245275799e-07 xi_scaled(31)=1.188721926575201 zeta(32)=-9.687608491494415e-23 Stats: nr=25 min=2 max=94 Safeguard: keep additional 2 states Emax=16.16367558428173 nrkept=202 nrkeptmult=446 Kept: 202 out of 744, ratio=0.272 Memory used: 20 MB Time elapsed: 2 s ***** [DM] Iteration 33/38 (scale 1.8552589123393861e-07) ***** [1] xi(32)=2.205386791134951e-07 xi_scaled(32)=1.188721841715382 zeta(33)=-3.429841855138418e-23 Stats: nr=27 min=1 max=113 Emax=14.3692399104601 nrkept=200 nrkeptmult=440 Kept: 200 out of 751, ratio=0.266 Memory used: 20 MB Time elapsed: 2 s ***** [DM] Iteration 34/38 (scale 1.0711342324555968e-07) ***** [1] xi(33)=1.273280659870069e-07 xi_scaled(33)=1.188721843900972 zeta(34)=-1.145886704580178e-23 Stats: nr=25 min=2 max=94 Safeguard: keep additional 20 states Emax=16.16376528537022 nrkept=220 nrkeptmult=486 Kept: 220 out of 744, ratio=0.296 Memory used: 21 MB Time elapsed: 2 s ***** [DM] Iteration 35/38 (scale 6.1841963744646202e-08) ***** [1] xi(34)=7.351289062754321e-08 xi_scaled(34)=1.188721802740415 zeta(35)=-3.819731089253127e-24 Stats: nr=29 min=1 max=119 Emax=14.36921816961268 nrkept=200 nrkeptmult=440 Kept: 200 out of 816, ratio=0.245 Memory used: 20 MB Time elapsed: 2 s ***** [DM] Iteration 36/38 (scale 3.5704474415186565e-08) ***** [1] xi(35)=4.244268751954171e-08 xi_scaled(35)=1.188721811893949 zeta(36)=-1.273243940986564e-24 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16376135694 nrkept=225 nrkeptmult=491 Kept: 225 out of 744, ratio=0.302 Memory used: 21 MB Time elapsed: 3 s ***** [DM] Iteration 37/38 (scale 2.0613987914882067e-08) ***** [1] xi(36)=2.45042954098163e-08 xi_scaled(36)=1.188721731622131 zeta(37)=-4.244145843705585e-25 Stats: nr=29 min=1 max=120 Emax=14.36921137417299 nrkept=200 nrkeptmult=440 Kept: 200 out of 831, ratio=0.241 Memory used: 22 MB Time elapsed: 3 s ***** [DM] Iteration 38/38 (scale 1.1901491471728852e-08) ***** [1] xi(37)=1.414756166524097e-08 xi_scaled(37)=1.188721741207604 zeta(38)=-1.41471543476728e-25 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16375706814691 nrkept=744 nrkeptmult=1760 Kept: 744 out of 744, ratio=1 Memory used: 22 MB Time elapsed: 3 s ** Iteration completed. Spectrum: A_d-A_d FDM [A_d-A_d] pos=0.4999999999999087 neg=0.499999999999908 sum= 0.9999999999998167 mu1=1.676436767183986e-14 mu2=1.489937460242114 mu3=8.903988657493755e-14 mu4=10.07291599125751 f=0.4999999999999087 b=0.4999999999999087 Spectrum: self_d-A_d FDM [self_d-A_d] pos=0.3605789262657756 neg=-0.3605789262657794 sum= -3.774758283725532e-15 mu1=1.080889654153231 mu2=4.907185768843192e-14 mu3=3.424354202093053 mu4=3.552713678800501e-15 f=0.3605789262657762 b=0.3605789262657745 Memory usage report =================== after diag: 22728 kB after recalc: 22728 kB after split: 22728 kB after trim: 22728 kB after trunc: 22728 kB diag_h: 9180 kB Peak usage: 22728 kB Timing report ============= All: 3 s DM: 0 s FDM: 0 s diag: 0 s recalc d: 0 s recalc f: 0 s recalc s: 0 s spec d: 0 s Other: 0 s