NRG Ljubljana 2.4.3.34 - (c) Rok Zitko Timestamp: Tue Jan 29 22:58:56 2019 Compiled on Mar 28 2019 at 12:04:50 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. [OMP] Max. number of threads: 1 [OMP] Number of processors: 32 [OMP] Dynamic thread adjustment: 0 [OMP] Nested parallelism: 0 Using Intel MKL library 2018.0.3 Processor optimization: Intel(R) Advanced Vector Extensions 2 (Intel(R) AVX2) enabled processors max_threads=1 blas_max_threads=1 dynamic=1 workdir=. substeps=0 Ninit=0 Lambda=4 strategy=kept lastall=1 lastalloverride=0 z=1 discretization=Z band=asymode bandrescale=1 betabar=1 T=1e-08 keep=5000 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=2 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 A_a self_a n_a SaSd specs= specd=A_d-A_d self_d-A_d A_a-A_a self_a-A_a A_a-A_d self_a-A_d A_d-A_a seld_d-A_a 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 1.251 V8 >> Number of channels, impurities, chain sites, subspaces: channels=2 impurities=2 Nmax=26 subspaces=15 Reading <||||> (e) Reading <||n_d||> (s) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||self_a||> (d) Reading <||n_a||> (s) Reading <||SaSd||> (s) Reading <||A_a||> (d) Reading <||self_a||> (d) Reading <||||> (z) length_coef_table=26 Nmax=26 Number of invariant subspaces: 15 (-4 1) 1 states 0.5017639462532439 (-3 2) 4 states 0.3174329990597511 0.3993673139087209 0.5766866780351857 0.6256485000266006 (-2 1) 10 states 0.1559220909288302 0.2236031987305133 0.3361399481236447 0.4246653006479448 0.4718568955619812 0.496232235110561 0.6039158200799267 0.6735881316910871 0.7645251509341381 0.7972677171088635 (-2 3) 6 states 0.2150363667152286 0.3923557308416928 0.4413175528331076 0.4742900456906628 0.5232518676820777 0.7005712318085423 (-1 2) 20 states 0.05824589846314587 0.1563756576669581 0.249062577149459 0.2899862656902796 0.3036907108584647 0.3287352785564555 0.3837606012755825 0.4130902748451515 0.4250547543387899 0.4910074564404271 0.4993693516926357 0.5703191326151844 0.5844981081171682 0.6063480329920446 0.6405568717727859 0.6589883598745306 0.6905717246102651 0.7425634544065999 0.8366848862144066 0.8966006066396957 (-1 4) 4 states 0.28995909849717 0.3389209204885846 0.5162402846150494 0.5981745994640194 (0 1) 20 states 0 0.1636140112342932 0.261745390300786 0.2867613472063274 0.339997002239852 0.3575488300331516 0.4032235471451541 0.4514242706531096 0.5023801299553835 0.5268505889469384 0.5360567781181119 0.5475688994312963 0.5958324962867634 0.6163685925205235 0.7113785220987332 0.7191189386981047 0.7765769915561574 0.7992239001143457 0.8679259912433144 1.03134779542001 (0 3) 15 states 0.1511910904303262 0.1960114796138047 0.2336552011293708 0.3088563831045273 0.3848228984321364 0.4068529890314126 0.477315638428179 0.4941936679689473 0.5286753718467638 0.5671866805713454 0.5720964338268978 0.6657184264373102 0.740854219155397 0.7592051676750908 0.8300546253023016 (0 5) 1 states 0.4138436522705266 (1 2) 20 states 0.1011033987681577 0.1598689945318452 0.2652770432841405 0.3522326103618824 0.3706727480436727 0.3893928759965066 0.4274415289994008 0.4535666219791346 0.4747220052645826 0.5380686410269022 0.5400142129540784 0.606466802352293 0.6244177798970533 0.6447079108953828 0.7093103481176432 0.7201890883563564 0.7364926620226209 0.8013167046491375 0.8967783038737438 0.9826592645115138 (1 4) 4 states 0.2889624359565861 0.3863230022278689 0.5944864354252891 0.6673609377882825 (2 1) 10 states 0.2275166341606716 0.3411270195640038 0.3864316425373399 0.4980553231749474 0.5852733835322368 0.6117850768418132 0.6916309646834421 0.7711792955548815 0.8496465295528849 0.9542601609812821 (2 3) 6 states 0.2614417859139282 0.4696052191113484 0.5424797214743419 0.5669657853826314 0.6398402877456248 0.8480037209430454 (3 2) 4 states 0.4420845690686907 0.5149590714316843 0.7231225046291044 0.8204830709003879 (4 1) 1 states 0.6956018545864469 Number of states (multiplicity taken into account): 256 Computing the following operators: s=[] p=[] g=[] d=[A_a A_d self_a self_d ] v=[] t=[] q=[] ot=[] Computing the following spectra: Before NRG iteration (N=-1) =-0.0002047797275440812 =0.9692092239257022 =0.9692386333206761 ***** [NRG] Iteration 1/26 (scale 0.54101064033336133) ***** [1] xi(0)=0.6285979344969106 xi_scaled(0)=1.161895696006237 zeta(1)=-0.02275586193656033 [2] xi(0)=0.6256210589350696 xi_scaled(0)=1.156393261599389 zeta(1)=0.04526644030108203 Stats: nr=28 min=1 max=210 Emax=8.278028191185093 nrkept=1647 nrkeptmult=3954 Total energy=-2.659961365899275 Egs=-3.978061736359924 Kept: 1647 out of 1716, ratio=0.96 =-0.000829134525840782 =0.9416683277199372 =0.9418579912978237 Memory used: 125 MB Time elapsed: 0 s ***** [NRG] Iteration 2/26 (scale 0.27050532016668066) ***** [1] xi(1)=0.3413758048054157 xi_scaled(1)=1.261992941932032 zeta(2)=-0.00724084151034457 [2] xi(1)=0.3423064892328008 xi_scaled(1)=1.265433482128475 zeta(2)=0.01464097285095394 Stats: nr=45 min=1 max=2243 Emax=8.00071006131728 nrkept=3703 nrkeptmult=9474 Total energy=-3.146580431478417 Egs=-1.798926044335454 Kept: 3703 out of 23359, ratio=0.159 =-0.003272579272039655 =0.8962529526281406 =0.897173521684714 Memory used: 395 MB Time elapsed: 24 s ***** [NRG] Iteration 3/26 (scale 0.13525266008334033) ***** [1] xi(2)=0.1776792319672008 xi_scaled(2)=1.313683825942632 zeta(3)=-0.002010168645251815 [2] xi(2)=0.1778387108356046 xi_scaled(2)=1.31486294410789 zeta(3)=0.00403856965763308 Stats: nr=59 min=1 max=4799 Emax=8.000947639459074 nrkept=2051 nrkeptmult=5064 Total energy=-3.667940556451148 Egs=-3.85471254059978 Kept: 2051 out of 53211, ratio=0.0385 =-0.01262125534936543 =0.8362937470110368 =0.8391679382198912 Memory used: 1265 MB Time elapsed: 243 s ***** [NRG] Iteration 4/26 (scale 0.067626330041670166) ***** [1] xi(3)=0.08982590183651309 xi_scaled(3)=1.328268172783647 zeta(4)=-0.000553601916925789 [2] xi(3)=0.08984478180160374 xi_scaled(3)=1.328547353467842 zeta(4)=0.001109747523289588 Stats: nr=48 min=1 max=2869 Emax=8.000906906285932 nrkept=2231 nrkeptmult=5821 Total energy=-3.809868546830503 Egs=-2.098709042645099 Kept: 2231 out of 29336, ratio=0.076 =-0.03836919783189498 =0.7891863148386781 =0.7967383240810444 Memory used: 1265 MB Time elapsed: 289 s ***** [NRG] Iteration 5/26 (scale 0.033813165020835083) ***** [1] xi(4)=0.04504118058830577 xi_scaled(4)=1.332060472912021 zeta(5)=-0.0001406744354346137 [2] xi(4)=0.0450438705566763 xi_scaled(4)=1.332140026789005 zeta(5)=0.0002819589065411061 Stats: nr=56 min=1 max=2999 Emax=8.001770018778078 nrkept=993 nrkeptmult=2479 Total energy=-3.933859307328721 Egs=-3.666937431672453 Kept: 993 out of 32183, ratio=0.0309 =-0.09403296498872847 =0.7694234323252235 =0.7870133219698702 Memory used: 899 MB Time elapsed: 339 s ***** [NRG] Iteration 6/26 (scale 0.016906582510417541) ***** [1] xi(5)=0.02253665260744706 xi_scaled(5)=1.333010535604128 zeta(6)=-3.98135990815631e-05 [2] xi(5)=0.02253678398305813 xi_scaled(5)=1.333018306282263 zeta(6)=7.978065209419781e-05 Stats: nr=43 min=1 max=1481 Emax=8.000851673171669 nrkept=965 nrkeptmult=2449 Total energy=-3.971401025088798 Egs=-2.220538523202122 Kept: 965 out of 14214, ratio=0.0679 =-0.1713362402030243 =0.7631513441137808 =0.7870300176999373 Memory used: 899 MB Time elapsed: 345 s ***** [NRG] Iteration 7/26 (scale 0.0084532912552087707) ***** [1] xi(6)=0.01127037560248515 xi_scaled(6)=1.33325296174322 zeta(7)=-1.012261326820289e-05 [2] xi(6)=0.01127040122826004 xi_scaled(6)=1.333255993198556 zeta(7)=2.028721440682201e-05 Stats: nr=46 min=1 max=1419 Emax=8.003009995145584 nrkept=478 nrkeptmult=1132 Total energy=-4.00170489973255 Egs=-3.584861059303817 Kept: 478 out of 13864, ratio=0.0345 =-0.2385432281987731 =0.777534545658548 =0.7982298300775337 Memory used: 899 MB Time elapsed: 350 s ***** [NRG] Iteration 8/26 (scale 0.0042266456276043854) ***** [1] xi(7)=0.005635438154230362 xi_scaled(7)=1.333312193817503 zeta(8)=-3.103488027110805e-06 [2] xi(7)=0.00563542812085402 xi_scaled(7)=1.333309819978477 zeta(8)=6.217837874434789e-06 Stats: nr=40 min=1 max=767 Emax=8.003651135952502 nrkept=503 nrkeptmult=1193 Total energy=-4.01117023005395 Egs=-2.239442611318422 Kept: 503 out of 6779, ratio=0.0742 =-0.2747895568869355 =0.7968546599833154 =0.8130627630277879 Memory used: 899 MB Time elapsed: 351 s ***** [NRG] Iteration 9/26 (scale 0.0021133228138021927) ***** [1] xi(8)=0.002817752705568553 xi_scaled(8)=1.33332810641408 zeta(9)=-7.964789825458177e-07 [2] xi(8)=0.002817751821962491 xi_scaled(8)=1.333327688301875 zeta(9)=1.595805226179388e-06 Stats: nr=41 min=1 max=780 Emax=8.004996958812336 nrkept=321 nrkeptmult=727 Total energy=-4.018716078902699 Egs=-3.570608711299102 Kept: 321 out of 7129, ratio=0.045 =-0.2899550734267902 =0.8065745812990641 =0.8209229247805201 Memory used: 899 MB Time elapsed: 352 s ***** [NRG] Iteration 10/26 (scale 0.0010566614069010963) ***** [1] xi(9)=0.001408880216444276 xi_scaled(9)=1.333331762892848 zeta(10)=-2.706841693388346e-07 [2] xi(9)=0.00140887927013198 xi_scaled(9)=1.333330867324704 zeta(10)=5.420933451577117e-07 Stats: nr=39 min=1 max=538 Emax=8.000771046834291 nrkept=388 nrkeptmult=885 Total energy=-4.021069200640201 Egs=-2.226940174150222 Kept: 388 out of 4504, ratio=0.0861 =-0.2935098133358929 =0.8089802464246146 =0.822813657211559 Memory used: 899 MB Time elapsed: 353 s ***** [NRG] Iteration 11/26 (scale 0.00052833070345054817) ***** [1] xi(10)=0.0007044407360724031 xi_scaled(10)=1.333332951258887 zeta(11)=-7.024270897944222e-08 [2] xi(10)=0.0007044406348194901 xi_scaled(10)=1.333332759612041 zeta(11)=1.406708537657281e-07 Stats: nr=40 min=1 max=620 Emax=8.031168694222288 nrkept=282 nrkeptmult=630 Total energy=-4.022955937810178 Egs=-3.57112913872816 Kept: 282 out of 5449, ratio=0.0518 =-0.2949129902293853 =0.8099244946563844 =0.8236238608105468 Memory used: 899 MB Time elapsed: 353 s ***** [NRG] Iteration 12/26 (scale 0.00026416535172527408) ***** [1] xi(11)=0.000352220426246654 xi_scaled(11)=1.333333171615009 zeta(12)=-2.650586202189971e-08 [2] xi(11)=0.0003522203610072374 xi_scaled(11)=1.333332924650688 zeta(12)=5.305850803646372e-08 Stats: nr=37 min=1 max=462 Emax=8.007620051353239 nrkept=365 nrkeptmult=830 Total energy=-4.023542436675089 Egs=-2.220196029040431 Kept: 365 out of 3944, ratio=0.0925 =-0.2949825281866675 =0.8099683124253267 =0.823637248401151 Memory used: 899 MB Time elapsed: 354 s ***** [NRG] Iteration 13/26 (scale 0.00013208267586263704) ***** [1] xi(12)=0.0001761102293837927 xi_scaled(12)=1.333333294723248 zeta(13)=-6.947850455256688e-09 [2] xi(12)=0.0001761102221548488 xi_scaled(12)=1.333333239992801 zeta(13)=1.390752756503091e-08 Stats: nr=40 min=1 max=576 Emax=8.005216868072338 nrkept=276 nrkeptmult=615 Total energy=-4.024014211969404 Egs=-3.571818114936236 Kept: 276 out of 5123, ratio=0.0539 =-0.2951588715089637 =0.8100889295038186 =0.8237482218376062 Memory used: 899 MB Time elapsed: 354 s ***** [NRG] Iteration 14/26 (scale 6.6041337931318521e-05) ***** [1] xi(13)=8.80551155284575e-05 xi_scaled(13)=1.333333307390483 zeta(14)=-2.855103473179467e-09 [2] xi(13)=8.805511124093189e-05 xi_scaled(13)=1.333333242468637 zeta(14)=5.713176964096603e-09 Stats: nr=37 min=1 max=456 Emax=8.030526252968802 nrkept=360 nrkeptmult=818 Total energy=-4.024160705696962 Egs=-2.218212594520389 Kept: 360 out of 3852, ratio=0.0935 =-0.2951258533425731 =0.8100653048441159 =0.8237230203365851 Memory used: 899 MB Time elapsed: 355 s ***** [NRG] Iteration 15/26 (scale 3.3020668965659261e-05) ***** [1] xi(14)=4.402755838888301e-05 xi_scaled(14)=1.333333326307552 zeta(15)=-7.5394805091992e-10 [2] xi(14)=4.402755795782227e-05 xi_scaled(14)=1.333333313253281 zeta(15)=1.50864261918061e-09 Stats: nr=40 min=1 max=563 Emax=8.000140379517255 nrkept=274 nrkeptmult=610 Total energy=-4.024278655571765 Egs=-3.572001370566977 Kept: 274 out of 5051, ratio=0.0542 =-0.2951606314792808 =0.8100894563435684 =0.8237462779311009 Memory used: 899 MB Time elapsed: 355 s ***** [NRG] Iteration 16/26 (scale 1.651033448282963e-05) ***** [1] xi(15)=2.201377923892957e-05 xi_scaled(15)=1.33333332900211 zeta(16)=-3.282545350939209e-10 [2] xi(15)=2.201377888354067e-05 xi_scaled(15)=1.333333307476871 zeta(16)=6.566960890378207e-10 Stats: nr=37 min=1 max=454 Emax=8.036133547908266 nrkept=360 nrkeptmult=818 Total energy=-4.024315270039927 Egs=-2.217669678393924 Kept: 360 out of 3826, ratio=0.0941 =-0.2951488777153775 =0.8100811267616019 =0.8237379456913297 Memory used: 899 MB Time elapsed: 355 s ***** [NRG] Iteration 17/26 (scale 8.2551672414148151e-06) ***** [1] xi(16)=1.100688962092936e-05 xi_scaled(16)=1.333333329179524 zeta(17)=-8.708567512840929e-11 [2] xi(16)=1.100688963558521e-05 xi_scaled(16)=1.333333330954878 zeta(17)=1.742181966376365e-10 Stats: nr=40 min=1 max=563 Emax=8.000139286030356 nrkept=272 nrkeptmult=605 Total energy=-4.024344758120235 Egs=-3.572075458459705 Kept: 272 out of 5051, ratio=0.0539 =-0.2951565546029058 =0.810086465706633 =0.8237431654928589 Memory used: 899 MB Time elapsed: 356 s ***** [NRG] Iteration 18/26 (scale 4.1275836207074076e-06) ***** [1] xi(17)=5.503444847803601e-06 xi_scaled(17)=1.333333338225717 zeta(18)=-3.924241694887695e-11 [2] xi(17)=5.503444741691813e-06 xi_scaled(17)=1.333333312517749 zeta(18)=7.849654347712833e-11 Stats: nr=37 min=1 max=451 Emax=8.037510519317191 nrkept=360 nrkeptmult=818 Total energy=-4.024353911143205 Egs=-2.21752575128539 Kept: 360 out of 3795, ratio=0.0949 =-0.2951532510020825 =0.8100841230519689 =0.8237408492678047 Memory used: 899 MB Time elapsed: 356 s ***** [NRG] Iteration 19/26 (scale 2.0637918103537038e-06) ***** [1] xi(18)=2.751722394980177e-06 xi_scaled(18)=1.333333324211889 zeta(19)=-1.043864903705374e-11 [2] xi(18)=2.751722434783217e-06 xi_scaled(18)=1.333333343498253 zeta(19)=2.088021079301789e-11 Stats: nr=40 min=1 max=563 Emax=8.000381826620222 nrkept=271 nrkeptmult=603 Total energy=-4.024361283149404 Egs=-3.572068734093178 Kept: 271 out of 5051, ratio=0.0537 =-0.2951550993008355 =0.8100854094866047 =0.8237421130505581 Memory used: 899 MB Time elapsed: 357 s ***** [NRG] Iteration 20/26 (scale 1.0318959051768519e-06) ***** [1] xi(19)=1.37586123099913e-06 xi_scaled(19)=1.333333356685167 zeta(20)=-4.793568749961559e-12 [2] xi(19)=1.375861150631197e-06 xi_scaled(19)=1.333333278801406 zeta(20)=9.58786014320601e-12 Stats: nr=37 min=1 max=450 Emax=8.037877856339287 nrkept=360 nrkeptmult=818 Total energy=-4.024363571379711 Egs=-2.217501101305843 Kept: 360 out of 3780, ratio=0.0952 =-0.2951542251994816 =0.810084789574498 =0.8237415018316285 Memory used: 899 MB Time elapsed: 357 s ***** [NRG] Iteration 21/26 (scale 5.1594795258842595e-07) ***** [1] xi(20)=6.879306017367717e-07 xi_scaled(20)=1.333333330010396 zeta(21)=-1.27704395554381e-12 [2] xi(20)=6.879306002300988e-07 xi_scaled(20)=1.333333327090192 zeta(21)=2.554257101240513e-12 Stats: nr=40 min=1 max=563 Emax=8.000518504244704 nrkept=271 nrkeptmult=603 Total energy=-4.024365414375074 Egs=-3.572056743050823 Kept: 271 out of 5051, ratio=0.0537 =-0.2951546854861462 =0.8100851101577005 =0.8237418172118556 Memory used: 899 MB Time elapsed: 357 s ***** [NRG] Iteration 22/26 (scale 2.5797397629421297e-07) ***** [1] xi(21)=3.439653066840087e-07 xi_scaled(21)=1.333333352553844 zeta(22)=-5.922650539348332e-13 [2] xi(21)=3.439652886843538e-07 xi_scaled(21)=1.333333282780701 zeta(22)=1.18457079030774e-12 Stats: nr=37 min=1 max=450 Emax=8.037975465754663 nrkept=360 nrkeptmult=818 Total energy=-4.024365986433715 Egs=-2.21750522532694 Kept: 360 out of 3780, ratio=0.0952 =-0.2951544606305003 =0.8100849505546811 =0.8237416599557198 Memory used: 899 MB Time elapsed: 358 s ***** [NRG] Iteration 23/26 (scale 1.2898698814710649e-07) ***** [1] xi(22)=1.719826505847006e-07 xi_scaled(22)=1.333333331177239 zeta(23)=-1.579708773758604e-13 [2] xi(22)=1.719826481990678e-07 xi_scaled(22)=1.333333312682096 zeta(23)=3.159457527930608e-13 Stats: nr=40 min=1 max=563 Emax=8.00056081928291 nrkept=271 nrkeptmult=603 Total energy=-4.024366447180821 Egs=-3.572043295209841 Kept: 271 out of 5051, ratio=0.0537 =-0.2951545769773933 =0.8100850316648317 =0.8237417397834098 Memory used: 899 MB Time elapsed: 358 s ***** [NRG] Iteration 24/26 (scale 6.4493494073553243e-08) ***** [1] xi(23)=8.599132532918157e-08 xi_scaled(23)=1.333333331748325 zeta(24)=-7.362610843920161e-14 [2] xi(23)=8.599132413073315e-08 xi_scaled(23)=1.333333313165854 zeta(24)=1.472525422734443e-13 Stats: nr=37 min=1 max=450 Emax=8.038003025104898 nrkept=360 nrkeptmult=818 Total energy=-4.024366590196174 Egs=-2.217515971585236 Kept: 360 out of 3780, ratio=0.0952 =-0.2951545196130984 =0.8100849909160168 =0.8237416996404727 Memory used: 899 MB Time elapsed: 358 s ***** [NRG] Iteration 25/26 (scale 3.2246747036776622e-08) ***** [1] xi(24)=4.299566222955418e-08 xi_scaled(24)=1.333333318257456 zeta(25)=-1.968117439806799e-14 [2] xi(24)=4.299566208458454e-08 xi_scaled(24)=1.333333313761821 zeta(25)=3.935932254256071e-14 Stats: nr=40 min=1 max=563 Safeguard: keep additional 1 states Emax=8.000585812503132 nrkept=272 nrkeptmult=605 Total energy=-4.024366705382509 Egs=-3.572029601154005 Kept: 272 out of 5051, ratio=0.0539 =-0.2951545491745005 =0.8100850115506847 =0.8237417199520999 Memory used: 899 MB Time elapsed: 359 s ***** [NRG] Iteration 26/26 (scale 1.6123373518388311e-08) ***** [1] xi(25)=2.14978311324157e-08 xi_scaled(25)=1.333333319351434 zeta(26)=-9.190909672872096e-15 [2] xi(25)=2.149783105973181e-08 xi_scaled(25)=1.333333314843452 zeta(26)=1.838072742416683e-14 Stats: nr=37 min=1 max=451 Emax=8.038012948920379 nrkept=3795 nrkeptmult=9680 Total energy=-4.024366741136545 Egs=-2.217528166172617 Kept: 3795 out of 3795, ratio=1 =-0.2951545350375309 =0.8100850014942081 =0.823741710045145 Memory used: 899 MB Time elapsed: 359 s ** Iteration completed. Total energy: -4.024366741136545 TKW=0.0071663070223135 Grand canonical Z= 7.843147671140317 Zft (last shell)= 7.843147630761214 Calculating density matrices. [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] 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 1.251 V8 >> Number of channels, impurities, chain sites, subspaces: channels=2 impurities=2 Nmax=26 subspaces=15 Reading <||||> (e) Reading <||n_d||> (s) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||self_a||> (d) Reading <||n_a||> (s) Reading <||SaSd||> (s) Reading <||A_a||> (d) Reading <||self_a||> (d) Reading <||||> (z) Number of invariant subspaces: 15 (-4 1) 1 states 0.5017639462532439 (-3 2) 4 states 0.3174329990597511 0.3993673139087209 0.5766866780351857 0.6256485000266006 (-2 1) 10 states 0.1559220909288302 0.2236031987305133 0.3361399481236447 0.4246653006479448 0.4718568955619812 0.496232235110561 0.6039158200799267 0.6735881316910871 0.7645251509341381 0.7972677171088635 (-2 3) 6 states 0.2150363667152286 0.3923557308416928 0.4413175528331076 0.4742900456906628 0.5232518676820777 0.7005712318085423 (-1 2) 20 states 0.05824589846314587 0.1563756576669581 0.249062577149459 0.2899862656902796 0.3036907108584647 0.3287352785564555 0.3837606012755825 0.4130902748451515 0.4250547543387899 0.4910074564404271 0.4993693516926357 0.5703191326151844 0.5844981081171682 0.6063480329920446 0.6405568717727859 0.6589883598745306 0.6905717246102651 0.7425634544065999 0.8366848862144066 0.8966006066396957 (-1 4) 4 states 0.28995909849717 0.3389209204885846 0.5162402846150494 0.5981745994640194 (0 1) 20 states 0 0.1636140112342932 0.261745390300786 0.2867613472063274 0.339997002239852 0.3575488300331516 0.4032235471451541 0.4514242706531096 0.5023801299553835 0.5268505889469384 0.5360567781181119 0.5475688994312963 0.5958324962867634 0.6163685925205235 0.7113785220987332 0.7191189386981047 0.7765769915561574 0.7992239001143457 0.8679259912433144 1.03134779542001 (0 3) 15 states 0.1511910904303262 0.1960114796138047 0.2336552011293708 0.3088563831045273 0.3848228984321364 0.4068529890314126 0.477315638428179 0.4941936679689473 0.5286753718467638 0.5671866805713454 0.5720964338268978 0.6657184264373102 0.740854219155397 0.7592051676750908 0.8300546253023016 (0 5) 1 states 0.4138436522705266 (1 2) 20 states 0.1011033987681577 0.1598689945318452 0.2652770432841405 0.3522326103618824 0.3706727480436727 0.3893928759965066 0.4274415289994008 0.4535666219791346 0.4747220052645826 0.5380686410269022 0.5400142129540784 0.606466802352293 0.6244177798970533 0.6447079108953828 0.7093103481176432 0.7201890883563564 0.7364926620226209 0.8013167046491375 0.8967783038737438 0.9826592645115138 (1 4) 4 states 0.2889624359565861 0.3863230022278689 0.5944864354252891 0.6673609377882825 (2 1) 10 states 0.2275166341606716 0.3411270195640038 0.3864316425373399 0.4980553231749474 0.5852733835322368 0.6117850768418132 0.6916309646834421 0.7711792955548815 0.8496465295528849 0.9542601609812821 (2 3) 6 states 0.2614417859139282 0.4696052191113484 0.5424797214743419 0.5669657853826314 0.6398402877456248 0.8480037209430454 (3 2) 4 states 0.4420845690686907 0.5149590714316843 0.7231225046291044 0.8204830709003879 (4 1) 1 states 0.6956018545864469 Number of states (multiplicity taken into account): 256 Computing the following operators: s=[] p=[] g=[] d=[A_a A_d self_a self_d ] v=[] t=[] q=[] ot=[] Computing the following spectra: Spectrum: A_a-A_a FDM Spectrum: A_a-A_d FDM Spectrum: A_d-A_a FDM Spectrum: A_d-A_d FDM Spectrum: self_a-A_a FDM Spectrum: self_a-A_d FDM Spectrum: self_d-A_d FDM ***** [DM] Iteration 1/26 (scale 0.54101064033336133) ***** [1] xi(0)=0.6285979344969106 xi_scaled(0)=1.161895696006237 zeta(1)=-0.02275586193656033 [2] xi(0)=0.6256210589350696 xi_scaled(0)=1.156393261599389 zeta(1)=0.04526644030108203 Stats: nr=28 min=1 max=210 Emax=8.278028191185093 nrkept=1647 nrkeptmult=3954 Kept: 1647 out of 1716, ratio=0.96 Memory used: 925 MB Time elapsed: 428 s ***** [DM] Iteration 2/26 (scale 0.27050532016668066) ***** [1] xi(1)=0.3413758048054157 xi_scaled(1)=1.261992941932032 zeta(2)=-0.00724084151034457 [2] xi(1)=0.3423064892328008 xi_scaled(1)=1.265433482128475 zeta(2)=0.01464097285095394 Stats: nr=45 min=1 max=2243 Emax=8.00071006131728 nrkept=3703 nrkeptmult=9474 Kept: 3703 out of 23359, ratio=0.159 Memory used: 1556 MB Time elapsed: 482 s ***** [DM] Iteration 3/26 (scale 0.13525266008334033) ***** [1] xi(2)=0.1776792319672008 xi_scaled(2)=1.313683825942632 zeta(3)=-0.002010168645251815 [2] xi(2)=0.1778387108356046 xi_scaled(2)=1.31486294410789 zeta(3)=0.00403856965763308 Stats: nr=59 min=1 max=4799 Emax=8.000947639459074 nrkept=2051 nrkeptmult=5064 Kept: 2051 out of 53211, ratio=0.0385 Memory used: 2275 MB Time elapsed: 896 s ***** [DM] Iteration 4/26 (scale 0.067626330041670166) ***** [1] xi(3)=0.08982590183651309 xi_scaled(3)=1.328268172783647 zeta(4)=-0.000553601916925789 [2] xi(3)=0.08984478180160374 xi_scaled(3)=1.328547353467842 zeta(4)=0.001109747523289588 Stats: nr=48 min=1 max=2869 Emax=8.000906906285932 nrkept=2231 nrkeptmult=5821 Kept: 2231 out of 29336, ratio=0.076 Memory used: 2275 MB Time elapsed: 997 s ***** [DM] Iteration 5/26 (scale 0.033813165020835083) ***** [1] xi(4)=0.04504118058830577 xi_scaled(4)=1.332060472912021 zeta(5)=-0.0001406744354346137 [2] xi(4)=0.0450438705566763 xi_scaled(4)=1.332140026789005 zeta(5)=0.0002819589065411061 Stats: nr=56 min=1 max=2999 Emax=8.001770018778078 nrkept=993 nrkeptmult=2479 Kept: 993 out of 32183, ratio=0.0309 Memory used: 2553 MB Time elapsed: 1110 s ***** [DM] Iteration 6/26 (scale 0.016906582510417541) ***** [1] xi(5)=0.02253665260744706 xi_scaled(5)=1.333010535604128 zeta(6)=-3.98135990815631e-05 [2] xi(5)=0.02253678398305813 xi_scaled(5)=1.333018306282263 zeta(6)=7.978065209419781e-05 Stats: nr=43 min=1 max=1481 Emax=8.000851673171669 nrkept=965 nrkeptmult=2449 Kept: 965 out of 14214, ratio=0.0679 Memory used: 2275 MB Time elapsed: 1126 s ***** [DM] Iteration 7/26 (scale 0.0084532912552087707) ***** [1] xi(6)=0.01127037560248515 xi_scaled(6)=1.33325296174322 zeta(7)=-1.012261326820289e-05 [2] xi(6)=0.01127040122826004 xi_scaled(6)=1.333255993198556 zeta(7)=2.028721440682201e-05 Stats: nr=46 min=1 max=1419 Emax=8.003009995145584 nrkept=478 nrkeptmult=1132 Kept: 478 out of 13864, ratio=0.0345 Memory used: 1890 MB Time elapsed: 1141 s ***** [DM] Iteration 8/26 (scale 0.0042266456276043854) ***** [1] xi(7)=0.005635438154230362 xi_scaled(7)=1.333312193817503 zeta(8)=-3.103488027110805e-06 [2] xi(7)=0.00563542812085402 xi_scaled(7)=1.333309819978477 zeta(8)=6.217837874434789e-06 Stats: nr=40 min=1 max=767 Emax=8.003651135952502 nrkept=503 nrkeptmult=1193 Kept: 503 out of 6779, ratio=0.0742 Memory used: 1890 MB Time elapsed: 1144 s ***** [DM] Iteration 9/26 (scale 0.0021133228138021927) ***** [1] xi(8)=0.002817752705568553 xi_scaled(8)=1.33332810641408 zeta(9)=-7.964789825458177e-07 [2] xi(8)=0.002817751821962491 xi_scaled(8)=1.333327688301875 zeta(9)=1.595805226179388e-06 Stats: nr=41 min=1 max=780 Emax=8.004996958812336 nrkept=321 nrkeptmult=727 Kept: 321 out of 7129, ratio=0.045 Memory used: 1890 MB Time elapsed: 1148 s ***** [DM] Iteration 10/26 (scale 0.0010566614069010963) ***** [1] xi(9)=0.001408880216444276 xi_scaled(9)=1.333331762892848 zeta(10)=-2.706841693388346e-07 [2] xi(9)=0.00140887927013198 xi_scaled(9)=1.333330867324704 zeta(10)=5.420933451577117e-07 Stats: nr=39 min=1 max=538 Emax=8.000771046834291 nrkept=388 nrkeptmult=885 Kept: 388 out of 4504, ratio=0.0861 Memory used: 1890 MB Time elapsed: 1149 s ***** [DM] Iteration 11/26 (scale 0.00052833070345054817) ***** [1] xi(10)=0.0007044407360724031 xi_scaled(10)=1.333332951258887 zeta(11)=-7.024270897944222e-08 [2] xi(10)=0.0007044406348194901 xi_scaled(10)=1.333332759612041 zeta(11)=1.406708537657281e-07 Stats: nr=40 min=1 max=620 Emax=8.031168694222288 nrkept=282 nrkeptmult=630 Kept: 282 out of 5449, ratio=0.0518 Memory used: 1890 MB Time elapsed: 1151 s ***** [DM] Iteration 12/26 (scale 0.00026416535172527408) ***** [1] xi(11)=0.000352220426246654 xi_scaled(11)=1.333333171615009 zeta(12)=-2.650586202189971e-08 [2] xi(11)=0.0003522203610072374 xi_scaled(11)=1.333332924650688 zeta(12)=5.305850803646372e-08 Stats: nr=37 min=1 max=462 Emax=8.007620051353239 nrkept=365 nrkeptmult=830 Kept: 365 out of 3944, ratio=0.0925 Memory used: 1890 MB Time elapsed: 1152 s ***** [DM] Iteration 13/26 (scale 0.00013208267586263704) ***** [1] xi(12)=0.0001761102293837927 xi_scaled(12)=1.333333294723248 zeta(13)=-6.947850455256688e-09 [2] xi(12)=0.0001761102221548488 xi_scaled(12)=1.333333239992801 zeta(13)=1.390752756503091e-08 Stats: nr=40 min=1 max=576 Emax=8.005216868072338 nrkept=276 nrkeptmult=615 Kept: 276 out of 5123, ratio=0.0539 Memory used: 1890 MB Time elapsed: 1154 s ***** [DM] Iteration 14/26 (scale 6.6041337931318521e-05) ***** [1] xi(13)=8.80551155284575e-05 xi_scaled(13)=1.333333307390483 zeta(14)=-2.855103473179467e-09 [2] xi(13)=8.805511124093189e-05 xi_scaled(13)=1.333333242468637 zeta(14)=5.713176964096603e-09 Stats: nr=37 min=1 max=456 Emax=8.030526252968802 nrkept=360 nrkeptmult=818 Kept: 360 out of 3852, ratio=0.0935 Memory used: 1890 MB Time elapsed: 1155 s ***** [DM] Iteration 15/26 (scale 3.3020668965659261e-05) ***** [1] xi(14)=4.402755838888301e-05 xi_scaled(14)=1.333333326307552 zeta(15)=-7.5394805091992e-10 [2] xi(14)=4.402755795782227e-05 xi_scaled(14)=1.333333313253281 zeta(15)=1.50864261918061e-09 Stats: nr=40 min=1 max=563 Emax=8.000140379517255 nrkept=274 nrkeptmult=610 Kept: 274 out of 5051, ratio=0.0542 Memory used: 1890 MB Time elapsed: 1157 s ***** [DM] Iteration 16/26 (scale 1.651033448282963e-05) ***** [1] xi(15)=2.201377923892957e-05 xi_scaled(15)=1.33333332900211 zeta(16)=-3.282545350939209e-10 [2] xi(15)=2.201377888354067e-05 xi_scaled(15)=1.333333307476871 zeta(16)=6.566960890378207e-10 Stats: nr=37 min=1 max=454 Emax=8.036133547908266 nrkept=360 nrkeptmult=818 Kept: 360 out of 3826, ratio=0.0941 Memory used: 1890 MB Time elapsed: 1158 s ***** [DM] Iteration 17/26 (scale 8.2551672414148151e-06) ***** [1] xi(16)=1.100688962092936e-05 xi_scaled(16)=1.333333329179524 zeta(17)=-8.708567512840929e-11 [2] xi(16)=1.100688963558521e-05 xi_scaled(16)=1.333333330954878 zeta(17)=1.742181966376365e-10 Stats: nr=40 min=1 max=563 Emax=8.000139286030356 nrkept=272 nrkeptmult=605 Kept: 272 out of 5051, ratio=0.0539 Memory used: 1890 MB Time elapsed: 1160 s ***** [DM] Iteration 18/26 (scale 4.1275836207074076e-06) ***** [1] xi(17)=5.503444847803601e-06 xi_scaled(17)=1.333333338225717 zeta(18)=-3.924241694887695e-11 [2] xi(17)=5.503444741691813e-06 xi_scaled(17)=1.333333312517749 zeta(18)=7.849654347712833e-11 Stats: nr=37 min=1 max=451 Emax=8.037510519317191 nrkept=360 nrkeptmult=818 Kept: 360 out of 3795, ratio=0.0949 Memory used: 1890 MB Time elapsed: 1161 s ***** [DM] Iteration 19/26 (scale 2.0637918103537038e-06) ***** [1] xi(18)=2.751722394980177e-06 xi_scaled(18)=1.333333324211889 zeta(19)=-1.043864903705374e-11 [2] xi(18)=2.751722434783217e-06 xi_scaled(18)=1.333333343498253 zeta(19)=2.088021079301789e-11 Stats: nr=40 min=1 max=563 Emax=8.000381826620222 nrkept=271 nrkeptmult=603 Kept: 271 out of 5051, ratio=0.0537 Memory used: 1890 MB Time elapsed: 1163 s ***** [DM] Iteration 20/26 (scale 1.0318959051768519e-06) ***** [1] xi(19)=1.37586123099913e-06 xi_scaled(19)=1.333333356685167 zeta(20)=-4.793568749961559e-12 [2] xi(19)=1.375861150631197e-06 xi_scaled(19)=1.333333278801406 zeta(20)=9.58786014320601e-12 Stats: nr=37 min=1 max=450 Emax=8.037877856339287 nrkept=360 nrkeptmult=818 Kept: 360 out of 3780, ratio=0.0952 Memory used: 1890 MB Time elapsed: 1164 s ***** [DM] Iteration 21/26 (scale 5.1594795258842595e-07) ***** [1] xi(20)=6.879306017367717e-07 xi_scaled(20)=1.333333330010396 zeta(21)=-1.27704395554381e-12 [2] xi(20)=6.879306002300988e-07 xi_scaled(20)=1.333333327090192 zeta(21)=2.554257101240513e-12 Stats: nr=40 min=1 max=563 Emax=8.000518504244704 nrkept=271 nrkeptmult=603 Kept: 271 out of 5051, ratio=0.0537 Memory used: 1890 MB Time elapsed: 1166 s ***** [DM] Iteration 22/26 (scale 2.5797397629421297e-07) ***** [1] xi(21)=3.439653066840087e-07 xi_scaled(21)=1.333333352553844 zeta(22)=-5.922650539348332e-13 [2] xi(21)=3.439652886843538e-07 xi_scaled(21)=1.333333282780701 zeta(22)=1.18457079030774e-12 Stats: nr=37 min=1 max=450 Emax=8.037975465754663 nrkept=360 nrkeptmult=818 Kept: 360 out of 3780, ratio=0.0952 Memory used: 1890 MB Time elapsed: 1167 s ***** [DM] Iteration 23/26 (scale 1.2898698814710649e-07) ***** [1] xi(22)=1.719826505847006e-07 xi_scaled(22)=1.333333331177239 zeta(23)=-1.579708773758604e-13 [2] xi(22)=1.719826481990678e-07 xi_scaled(22)=1.333333312682096 zeta(23)=3.159457527930608e-13 Stats: nr=40 min=1 max=563 Emax=8.00056081928291 nrkept=271 nrkeptmult=603 Kept: 271 out of 5051, ratio=0.0537 Memory used: 1890 MB Time elapsed: 1168 s ***** [DM] Iteration 24/26 (scale 6.4493494073553243e-08) ***** [1] xi(23)=8.599132532918157e-08 xi_scaled(23)=1.333333331748325 zeta(24)=-7.362610843920161e-14 [2] xi(23)=8.599132413073315e-08 xi_scaled(23)=1.333333313165854 zeta(24)=1.472525422734443e-13 Stats: nr=37 min=1 max=450 Emax=8.038003025104898 nrkept=360 nrkeptmult=818 Kept: 360 out of 3780, ratio=0.0952 Memory used: 1890 MB Time elapsed: 1169 s ***** [DM] Iteration 25/26 (scale 3.2246747036776622e-08) ***** [1] xi(24)=4.299566222955418e-08 xi_scaled(24)=1.333333318257456 zeta(25)=-1.968117439806799e-14 [2] xi(24)=4.299566208458454e-08 xi_scaled(24)=1.333333313761821 zeta(25)=3.935932254256071e-14 Stats: nr=40 min=1 max=563 Safeguard: keep additional 1 states Emax=8.000585812503132 nrkept=272 nrkeptmult=605 Kept: 272 out of 5051, ratio=0.0539 Memory used: 1890 MB Time elapsed: 1171 s ***** [DM] Iteration 26/26 (scale 1.6123373518388311e-08) ***** [1] xi(25)=2.14978311324157e-08 xi_scaled(25)=1.333333319351434 zeta(26)=-9.190909672872096e-15 [2] xi(25)=2.149783105973181e-08 xi_scaled(25)=1.333333314843452 zeta(26)=1.838072742416683e-14 Stats: nr=37 min=1 max=451 Emax=8.038012948920379 nrkept=3795 nrkeptmult=9680 Kept: 3795 out of 3795, ratio=1 Memory used: 1890 MB Time elapsed: 1171 s ** Iteration completed. Spectrum: A_a-A_a FDM [A_a-A_a] pos=0.5949575297157178 neg=0.4050424702473079 sum= 0.9999999999630258 mu1=0.05184055586044536 mu2=0.03472251664661956 mu3=0.003537962270208141 mu4=0.01036046483183077 f=0.5949574999297281 b=0.5949575891694705 Spectrum: A_a-A_d FDM [A_a-A_d] pos=0.286183923650751 neg=-0.2861839236506061 sum= 1.449396158648142e-13 mu1=0.05094649572175045 mu2=0.005459644854223954 mu3=0.002499498003037566 mu4=0.0003556992973376038 f=0.2861839642670001 b=0.2861837795829482 Spectrum: A_d-A_a FDM [A_d-A_a] pos=0.2861839236512087 neg=-0.2861839236506971 sum= 5.115907697472721e-13 mu1=0.05095287173758063 mu2=0.005464124595694573 mu3=0.002500666893670377 mu4=0.0003562760864679512 f=0.2861839642674578 b=0.2861837795834059 Spectrum: A_d-A_d FDM [A_d-A_d] pos=0.5881291799975323 neg=0.4118708199648919 sum= 0.9999999999624243 mu1=0.05334908403057252 mu2=0.02851908039447868 mu3=0.004769340838171095 mu4=0.007194826102486051 f=0.588129145643841 b=0.5881292326462403 Spectrum: self_a-A_a FDM [self_a-A_a] pos=0.06258391543516736 neg=-0.0115754154268954 sum= 0.05100850000827196 mu1=0.01499301297228118 mu2=0.003839400919063027 mu3=0.001922907841227042 mu4=0.0009853783382181946 f=0.06258391670949001 b=0.06258390908413082 Spectrum: self_a-A_d FDM [self_a-A_d] pos=0.04233050952968564 neg=0.007669490465796382 sum= 0.04999999999548202 mu1=0.005290372478275664 mu2=0.001467760703571141 mu3=0.0003098504872529218 mu4=0.0003514461224388615 f=0.04233050906309325 b=0.04233050700199692 Spectrum: self_d-A_d FDM [self_d-A_d] pos=0.06582855720203822 neg=-0.01345438633661177 sum= 0.05237417086542644 mu1=0.01523072079076045 mu2=0.003537891111370608 mu3=0.001579706219648757 mu4=0.0007536926900218132 f=0.06582855828789537 b=0.06582855059299832 Memory usage report =================== after diag: 2614352 kB after recalc: 9031352 kB after split: 2614352 kB after trim: 2614352 kB after trunc: 2614352 kB diag_h: 1454444 kB Peak usage: 9031352 kB Timing report ============= All: 1171 s FDM: 65 s diag: 344 s recalc d: 477 s spec d: 264 s Other: 20 s