NRG Ljubljana 2.4.3.31 - (c) Rok Zitko Timestamp: Mon Nov 13 12:55:52 2017 Compiled on Aug 14 2018 at 10:37:37 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 11.3.2 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=2.5 strategy=kept lastall=1 lastalloverride=0 z=0.5 discretization=Z band=asymode bandrescale=1 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=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 specs= specd=n_d 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=41 subspaces=6 Reading <||||> (e) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||||> (z) length_coef_table=41 Nmax=41 Number of invariant subspaces: 6 (-2 1) 1 states 0.4152731870394235 (-1 2) 2 states 0.2156932579980535 0.3676179737716967 (0 1) 3 states 0.02670983359958123 0.2200103448420651 0.5628241997073855 (0 3) 1 states 0.1680380447303267 (1 2) 2 states 0 0.3942711911096084 (2 1) 1 states 0.2262331463792817 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) ***** [NRG] Iteration 1/41 (scale 1.0353518430881692) ***** [1] xi(0)=0.7410190148490526 xi_scaled(0)=0.7157170963629109 zeta(1)=0.1040814978927622 Stats: nr=10 min=1 max=8 Emax=3.308392664381781 nrkept=35 nrkeptmult=64 Total energy=-1.687282920881453 Egs=-1.219101282749719 Kept: 35 out of 35, ratio=1 Memory used: 43 MB Time elapsed: 0 s ***** [NRG] Iteration 2/41 (scale 0.65481400076237484) ***** [1] xi(1)=0.5959774984451153 xi_scaled(1)=0.9101477637180047 zeta(2)=0.02081491538624548 Stats: nr=15 min=1 max=20 Emax=6.777757453523025 nrkept=126 nrkeptmult=256 Total energy=-2.187859516776659 Egs=-0.7644561590198196 Kept: 126 out of 126, ratio=1 Memory used: 43 MB Time elapsed: 0 s ***** [NRG] Iteration 3/41 (scale 0.41414073723526762) ***** [1] xi(2)=0.5088460598519119 xi_scaled(2)=1.228679079601975 zeta(3)=0.08772286392885187 Stats: nr=21 min=1 max=75 Emax=8.01763759932058 nrkept=288 nrkeptmult=644 Total energy=-2.989953455233195 Egs=-1.936766577978243 Kept: 288 out of 462, ratio=0.623 Memory used: 59 MB Time elapsed: 0 s ***** [NRG] Iteration 4/41 (scale 0.26192560030494993) ***** [1] xi(3)=0.2482077253420286 xi_scaled(3)=0.9476268262936111 zeta(4)=0.01129659407761087 Stats: nr=28 min=1 max=127 Emax=8.003397606699746 nrkept=348 nrkeptmult=808 Total energy=-3.145629214072962 Egs=-0.594351062509808 Kept: 348 out of 1066, ratio=0.326 Memory used: 60 MB Time elapsed: 0 s ***** [NRG] Iteration 5/41 (scale 0.16565629489410705) ***** [1] xi(4)=0.1858710645608675 xi_scaled(4)=1.122028382197504 zeta(5)=0.01350854465800902 Stats: nr=31 min=1 max=175 Emax=8.05760649644469 nrkept=241 nrkeptmult=547 Total energy=-3.460492878322906 Egs=-1.900704494515081 Kept: 241 out of 1300, ratio=0.185 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 6/41 (scale 0.10477024012197998) ***** [1] xi(5)=0.09316760937360259 xi_scaled(5)=0.889256426873997 zeta(6)=0.001514151051430748 Stats: nr=26 min=1 max=114 Emax=8.001916350440871 nrkept=254 nrkeptmult=597 Total energy=-3.515486972984781 Egs=-0.5249018671508938 Kept: 254 out of 902, ratio=0.282 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 7/41 (scale 0.066262517957642819) ***** [1] xi(6)=0.07376257350317038 xi_scaled(6)=1.113186998875018 zeta(7)=0.00231213135328668 Stats: nr=31 min=1 max=132 Emax=8.374587918708142 nrkept=200 nrkeptmult=462 Total energy=-3.64367387974555 Egs=-1.934531175569118 Kept: 200 out of 951, ratio=0.21 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 8/41 (scale 0.04190809604879199) ***** [1] xi(7)=0.03710731104250132 xi_scaled(7)=0.8854449269014441 zeta(8)=0.0002541025172305283 Stats: nr=26 min=1 max=96 Emax=8.039412401459822 nrkept=210 nrkeptmult=518 Total energy=-3.664774347103935 Egs=-0.5034938197578424 Kept: 210 out of 750, ratio=0.28 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 9/41 (scale 0.026505007183057129) ***** [1] xi(8)=0.02948914182591378 xi_scaled(8)=1.112587580989761 zeta(9)=0.0004069505173869882 Stats: nr=31 min=1 max=105 Emax=9.195774968210245 nrkept=200 nrkeptmult=478 Total energy=-3.716734795764321 Egs=-1.960401229153445 Kept: 200 out of 792, ratio=0.253 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 10/41 (scale 0.016763238419516796) ***** [1] xi(9)=0.01483306681620043 xi_scaled(9)=0.8848568781871445 zeta(10)=4.383939976597838e-05 Stats: nr=26 min=1 max=94 Emax=8.6902402778337 nrkept=200 nrkeptmult=497 Total energy=-3.724976242530115 Egs=-0.4916381047351132 Kept: 200 out of 750, ratio=0.267 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 11/41 (scale 0.010602002873222851) ***** [1] xi(10)=0.01179471789284074 xi_scaled(10)=1.11249902814404 zeta(11)=7.260485967375988e-05 Stats: nr=31 min=1 max=100 Emax=9.536393876385532 nrkept=200 nrkeptmult=490 Total energy=-3.745939318424085 Egs=-1.977275062518255 Kept: 200 out of 754, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 12/41 (scale 0.0067052953678067191) ***** [1] xi(11)=0.005932509535239854 xi_scaled(11)=0.8847499192537971 zeta(12)=7.671578450342108e-06 Stats: nr=26 min=1 max=93 Emax=8.795173111993025 nrkept=200 nrkeptmult=499 Total energy=-3.749187798462612 Egs=-0.4844648684864056 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 13/41 (scale 0.0042408011492891399) ***** [1] xi(12)=0.004717822708545992 xi_scaled(12)=1.112483830876346 zeta(13)=1.311757673372667e-05 Stats: nr=31 min=1 max=100 Emax=9.603014013944122 nrkept=200 nrkeptmult=490 Total energy=-3.757619049604756 Egs=-1.988126970668501 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 14/41 (scale 0.0026821181471226871) ***** [1] xi(13)=0.002372952059578173 xi_scaled(13)=0.8847306231173374 zeta(14)=1.359556960475295e-06 Stats: nr=26 min=1 max=93 Emax=8.798940947373266 nrkept=200 nrkeptmult=499 Total energy=-3.758906398355399 Egs=-0.4799746618259741 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 15/41 (scale 0.001696320459715656) ***** [1] xi(14)=0.001887121936632542 xi_scaled(14)=1.11247961776566 zeta(15)=2.399020552227961e-06 Stats: nr=31 min=1 max=100 Emax=9.652633496353202 nrkept=200 nrkeptmult=490 Total energy=-3.762290707276988 Egs=-1.995088193510618 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 16/41 (scale 0.0010728472588490748) ***** [1] xi(15)=0.000949181856195082 xi_scaled(15)=0.8847315853827523 zeta(16)=2.439873678210424e-07 Stats: nr=26 min=1 max=92 Emax=8.798382502411087 nrkept=200 nrkeptmult=499 Total energy=-3.762802600702167 Egs=-0.4771354178861872 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 17/41 (scale 0.00067852818388626241) ***** [1] xi(16)=0.0007548441219237938 xi_scaled(16)=1.112472760675073 zeta(17)=4.438766126352822e-07 Stats: nr=31 min=1 max=100 Emax=9.698807231010877 nrkept=200 nrkeptmult=490 Total energy=-3.764159338263563 Egs=-1.999530150133286 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 18/41 (scale 0.00042913890353962997) ***** [1] xi(17)=0.0003796809648784362 xi_scaled(17)=0.8847507456134738 zeta(18)=4.43434579197502e-08 Stats: nr=26 min=1 max=92 Emax=8.797342588944039 nrkept=200 nrkeptmult=499 Total energy=-3.764363330313549 Egs=-0.4753520324164914 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 19/41 (scale 0.000271411273554505) ***** [1] xi(18)=0.0003019307862626538 xi_scaled(18)=1.11244747614369 zeta(19)=8.302025336957366e-08 Stats: nr=31 min=1 max=100 Emax=9.725726155966431 nrkept=200 nrkeptmult=490 Total energy=-3.764906781116461 Egs=-2.0023147741601 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 20/41 (scale 0.00017165556141585201) ***** [1] xi(19)=0.000151885934459659 xi_scaled(19)=0.8848296740686474 zeta(20)=8.166918626862049e-09 Stats: nr=26 min=1 max=92 Emax=8.796484971779618 nrkept=200 nrkeptmult=499 Total energy=-3.764988196793257 Egs=-0.4742967610496873 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 21/41 (scale 0.000108564509421802) ***** [1] xi(20)=0.0001207615082744172 xi_scaled(20)=1.112347938728546 zeta(21)=1.567915093485497e-08 Stats: nr=31 min=1 max=100 Emax=9.732541109677509 nrkept=200 nrkeptmult=490 Total energy=-3.765205748632227 Egs=-2.003894644104135 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 22/41 (scale 6.8662224566340798e-05) ***** [1] xi(21)=6.077583131409551e-05 xi_scaled(21)=0.885142182589416 zeta(22)=1.530423685655877e-09 Stats: nr=26 min=1 max=92 Emax=8.795886716335719 nrkept=200 nrkeptmult=499 Total energy=-3.765238289744121 Egs=-0.4739303467019573 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 23/41 (scale 4.3425803768720796e-05) ***** [1] xi(22)=4.82875430623737e-05 xi_scaled(22)=1.111955079048065 zeta(23)=2.985749262629318e-09 Stats: nr=31 min=1 max=100 Emax=9.732330117308823 nrkept=200 nrkeptmult=490 Total energy=-3.765325321230976 Egs=-2.004142221939586 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 24/41 (scale 2.7464889826536317e-05) ***** [1] xi(23)=2.434418086741709e-05 xi_scaled(23)=0.8863746048562691 zeta(24)=2.979238371939102e-10 Stats: nr=26 min=1 max=92 Emax=8.795494627208628 nrkept=200 nrkeptmult=499 Total energy=-3.765338364100567 Egs=-0.4748924781207154 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 25/41 (scale 1.7370321507488318e-05) ***** [1] xi(24)=1.928818977819493e-05 xi_scaled(24)=1.110410637470344 zeta(25)=5.726842489390972e-10 Stats: nr=31 min=1 max=100 Emax=9.732174913573115 nrkept=200 nrkeptmult=490 Total energy=-3.765373127858263 Egs=-2.001330699695369 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 26/41 (scale 1.0985955930614528e-05) ***** [1] xi(25)=9.790631478312447e-06 xi_scaled(25)=0.8911952259911152 zeta(26)=6.598910873030082e-11 Stats: nr=26 min=1 max=92 Emax=8.795248244402417 nrkept=200 nrkeptmult=499 Total energy=-3.765378403196095 Egs=-0.4801892402595912 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 27/41 (scale 6.948128602995327e-06) ***** [1] xi(26)=7.673894917665424e-06 xi_scaled(26)=1.10445493400298 zeta(27)=1.11591054983396e-10 Stats: nr=31 min=1 max=100 Emax=9.731980772855403 nrkept=200 nrkeptmult=490 Total energy=-3.765392216860322 Egs=-1.988112917305025 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 28/41 (scale 4.3943823722458113e-06) ***** [1] xi(27)=3.996177096961947e-06 xi_scaled(27)=0.9093831074421601 zeta(28)=2.159128539198777e-11 Stats: nr=26 min=1 max=92 Emax=8.795110039534247 nrkept=200 nrkeptmult=499 Total energy=-3.765394420527601 Egs=-0.5014737208457467 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 29/41 (scale 2.7792514411981313e-06) ***** [1] xi(28)=3.011534759762334e-06 xi_scaled(28)=1.083577655163171 zeta(29)=2.421397699290939e-11 Stats: nr=31 min=1 max=100 Emax=9.672288532975539 nrkept=200 nrkeptmult=490 Total energy=-3.765399811622871 Egs=-1.939765215305262 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 30/41 (scale 1.7577529488983243e-06) ***** [1] xi(29)=1.701057314970183e-06 xi_scaled(29)=0.967745391089416 zeta(30)=1.264336754233646e-11 Stats: nr=26 min=1 max=92 Emax=8.795075945779294 nrkept=200 nrkeptmult=499 Total energy=-3.765400822183814 Egs=-0.5749163690605203 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 31/41 (scale 1.1117005764792524e-06) ***** [1] xi(30)=1.156716176923296e-06 xi_scaled(30)=1.040492558334914 zeta(31)=9.267732313449569e-12 Stats: nr=31 min=1 max=100 Emax=9.49703888405676 nrkept=200 nrkeptmult=490 Total energy=-3.765402853509027 Egs=-1.827223315460106 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 32/41 (scale 7.0310117955932977e-07) ***** [1] xi(31)=7.533529377612041e-07 xi_scaled(31)=1.071471588532065 zeta(32)=1.021618393321195e-11 Stats: nr=26 min=1 max=92 Safeguard: keep additional 1 states Emax=8.795124752186702 nrkept=201 nrkeptmult=501 Total energy=-3.765403365886512 Egs=-0.7287393332460373 Kept: 201 out of 756, ratio=0.266 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 33/41 (scale 4.4468023059170098e-07) ***** [1] xi(32)=4.8438824160062e-07 xi_scaled(32)=1.089295651745261 zeta(33)=8.52970028771494e-12 Stats: nr=31 min=1 max=101 Emax=9.44599614538256 nrkept=200 nrkeptmult=490 Total energy=-3.765404185070636 Egs=-1.842186962892862 Kept: 200 out of 759, ratio=0.264 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 34/41 (scale 2.8124047182373188e-07) ***** [1] xi(33)=3.115993810360347e-07 xi_scaled(33)=1.107946445315773 zeta(34)=9.713349214836401e-12 Stats: nr=26 min=1 max=92 Emax=8.79499139897961 nrkept=200 nrkeptmult=499 Total energy=-3.765404403536182 Egs=-0.7767927043434306 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 35/41 (scale 1.7787209223668039e-07) ***** [1] xi(34)=1.978022480351426e-07 xi_scaled(34)=1.112047682960533 zeta(35)=1.013504265026389e-11 Stats: nr=31 min=1 max=100 Emax=9.445812662973866 nrkept=200 nrkeptmult=490 Total energy=-3.76540473443523 Egs=-1.860320207985116 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 36/41 (scale 1.1249618872949276e-07) ***** [1] xi(35)=1.251423123720037e-07 xi_scaled(35)=1.112413796283531 zeta(36)=9.110773847422819e-12 Stats: nr=26 min=1 max=92 Emax=8.794824773709632 nrkept=200 nrkeptmult=499 Total energy=-3.765404822080715 Egs=-0.7790973727199644 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 37/41 (scale 7.1148836894672156e-08) ***** [1] xi(36)=7.912894395889384e-08 xi_scaled(36)=1.11216075219944 zeta(37)=1.33165944395657e-11 Stats: nr=31 min=1 max=100 Emax=9.445011981948545 nrkept=200 nrkeptmult=490 Total energy=-3.765404954421149 Egs=-1.860050561226947 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 38/41 (scale 4.4998475491797109e-08) ***** [1] xi(37)=5.005030476578071e-08 xi_scaled(37)=1.112266676121161 zeta(38)=7.783756654266801e-12 Stats: nr=26 min=1 max=92 Emax=8.794213436690764 nrkept=200 nrkeptmult=499 Total energy=-3.765404989476166 Egs=-0.7790267489420063 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 0 s ***** [NRG] Iteration 39/41 (scale 2.8459534757868861e-08) ***** [1] xi(38)=3.163920723005588e-08 xi_scaled(38)=1.111726087556925 zeta(39)=1.516129607114603e-11 Stats: nr=31 min=1 max=100 Emax=9.443415773378712 nrkept=200 nrkeptmult=492 Total energy=-3.765405042390156 Egs=-1.859271103911362 Kept: 200 out of 755, ratio=0.265 Memory used: 61 MB Time elapsed: 1 s ***** [NRG] Iteration 40/41 (scale 1.7999390196718842e-08) ***** [1] xi(39)=2.001023075815577e-08 xi_scaled(39)=1.111717149273395 zeta(40)=6.612753688881832e-12 Stats: nr=26 min=1 max=92 Emax=8.792678115959092 nrkept=200 nrkeptmult=499 Total energy=-3.765405056407876 Egs=-0.7787886267609582 Kept: 200 out of 756, ratio=0.265 Memory used: 61 MB Time elapsed: 1 s ***** [NRG] Iteration 41/41 (scale 1.1383813903147544e-08) ***** [1] xi(40)=1.264912630733812e-08 xi_scaled(40)=1.111150130787075 zeta(41)=9.216575161210059e-12 Stats: nr=31 min=1 max=100 Emax=9.440677142774934 nrkept=755 nrkeptmult=1996 Total energy=-3.765405077559427 Egs=-1.858037235570924 Kept: 755 out of 755, ratio=1 Memory used: 61 MB Time elapsed: 1 s ** Iteration completed. Total energy: -3.765405077559427 TKW=0 Grand canonical Z= 8.804902966313589 Zft (last shell)= 8.804897946681352 Calculating density matrices. [DM] 40 [DM] 39 [DM] 38 [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] 40 [FDM] 39 [FDM] 38 [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=41 subspaces=6 Reading <||||> (e) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||||> (z) Number of invariant subspaces: 6 (-2 1) 1 states 0.4152731870394235 (-1 2) 2 states 0.2156932579980535 0.3676179737716967 (0 1) 3 states 0.02670983359958123 0.2200103448420651 0.5628241997073855 (0 3) 1 states 0.1680380447303267 (1 2) 2 states 0 0.3942711911096084 (2 1) 1 states 0.2262331463792817 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 1/41 (scale 1.0353518430881692) ***** [1] xi(0)=0.7410190148490526 xi_scaled(0)=0.7157170963629109 zeta(1)=0.1040814978927622 Stats: nr=10 min=1 max=8 Emax=3.308392664381781 nrkept=35 nrkeptmult=64 Kept: 35 out of 35, ratio=1 Memory used: 63 MB Time elapsed: 2 s ***** [DM] Iteration 2/41 (scale 0.65481400076237484) ***** [1] xi(1)=0.5959774984451153 xi_scaled(1)=0.9101477637180047 zeta(2)=0.02081491538624548 Stats: nr=15 min=1 max=20 Emax=6.777757453523025 nrkept=126 nrkeptmult=256 Kept: 126 out of 126, ratio=1 Memory used: 63 MB Time elapsed: 2 s ***** [DM] Iteration 3/41 (scale 0.41414073723526762) ***** [1] xi(2)=0.5088460598519119 xi_scaled(2)=1.228679079601975 zeta(3)=0.08772286392885187 Stats: nr=21 min=1 max=75 Emax=8.01763759932058 nrkept=288 nrkeptmult=644 Kept: 288 out of 462, ratio=0.623 Memory used: 63 MB Time elapsed: 2 s ***** [DM] Iteration 4/41 (scale 0.26192560030494993) ***** [1] xi(3)=0.2482077253420286 xi_scaled(3)=0.9476268262936111 zeta(4)=0.01129659407761087 Stats: nr=28 min=1 max=127 Emax=8.003397606699746 nrkept=348 nrkeptmult=808 Kept: 348 out of 1066, ratio=0.326 Memory used: 64 MB Time elapsed: 2 s ***** [DM] Iteration 5/41 (scale 0.16565629489410705) ***** [1] xi(4)=0.1858710645608675 xi_scaled(4)=1.122028382197504 zeta(5)=0.01350854465800902 Stats: nr=31 min=1 max=175 Emax=8.05760649644469 nrkept=241 nrkeptmult=547 Kept: 241 out of 1300, ratio=0.185 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 6/41 (scale 0.10477024012197998) ***** [1] xi(5)=0.09316760937360259 xi_scaled(5)=0.889256426873997 zeta(6)=0.001514151051430748 Stats: nr=26 min=1 max=114 Emax=8.001916350440871 nrkept=254 nrkeptmult=597 Kept: 254 out of 902, ratio=0.282 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 7/41 (scale 0.066262517957642819) ***** [1] xi(6)=0.07376257350317038 xi_scaled(6)=1.113186998875018 zeta(7)=0.00231213135328668 Stats: nr=31 min=1 max=132 Emax=8.374587918708142 nrkept=200 nrkeptmult=462 Kept: 200 out of 951, ratio=0.21 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 8/41 (scale 0.04190809604879199) ***** [1] xi(7)=0.03710731104250132 xi_scaled(7)=0.8854449269014441 zeta(8)=0.0002541025172305283 Stats: nr=26 min=1 max=96 Emax=8.039412401459822 nrkept=210 nrkeptmult=518 Kept: 210 out of 750, ratio=0.28 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 9/41 (scale 0.026505007183057129) ***** [1] xi(8)=0.02948914182591378 xi_scaled(8)=1.112587580989761 zeta(9)=0.0004069505173869882 Stats: nr=31 min=1 max=105 Emax=9.195774968210245 nrkept=200 nrkeptmult=478 Kept: 200 out of 792, ratio=0.253 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 10/41 (scale 0.016763238419516796) ***** [1] xi(9)=0.01483306681620043 xi_scaled(9)=0.8848568781871445 zeta(10)=4.383939976597838e-05 Stats: nr=26 min=1 max=94 Emax=8.6902402778337 nrkept=200 nrkeptmult=497 Kept: 200 out of 750, ratio=0.267 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 11/41 (scale 0.010602002873222851) ***** [1] xi(10)=0.01179471789284074 xi_scaled(10)=1.11249902814404 zeta(11)=7.260485967375988e-05 Stats: nr=31 min=1 max=100 Emax=9.536393876385532 nrkept=200 nrkeptmult=490 Kept: 200 out of 754, ratio=0.265 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 12/41 (scale 0.0067052953678067191) ***** [1] xi(11)=0.005932509535239854 xi_scaled(11)=0.8847499192537971 zeta(12)=7.671578450342108e-06 Stats: nr=26 min=1 max=93 Emax=8.795173111993025 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 13/41 (scale 0.0042408011492891399) ***** [1] xi(12)=0.004717822708545992 xi_scaled(12)=1.112483830876346 zeta(13)=1.311757673372667e-05 Stats: nr=31 min=1 max=100 Emax=9.603014013944122 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 14/41 (scale 0.0026821181471226871) ***** [1] xi(13)=0.002372952059578173 xi_scaled(13)=0.8847306231173374 zeta(14)=1.359556960475295e-06 Stats: nr=26 min=1 max=93 Emax=8.798940947373266 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 66 MB Time elapsed: 2 s ***** [DM] Iteration 15/41 (scale 0.001696320459715656) ***** [1] xi(14)=0.001887121936632542 xi_scaled(14)=1.11247961776566 zeta(15)=2.399020552227961e-06 Stats: nr=31 min=1 max=100 Emax=9.652633496353202 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 66 MB Time elapsed: 3 s ***** [DM] Iteration 16/41 (scale 0.0010728472588490748) ***** [1] xi(15)=0.000949181856195082 xi_scaled(15)=0.8847315853827523 zeta(16)=2.439873678210424e-07 Stats: nr=26 min=1 max=92 Emax=8.798382502411087 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 66 MB Time elapsed: 3 s ***** [DM] Iteration 17/41 (scale 0.00067852818388626241) ***** [1] xi(16)=0.0007548441219237938 xi_scaled(16)=1.112472760675073 zeta(17)=4.438766126352822e-07 Stats: nr=31 min=1 max=100 Emax=9.698807231010877 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 66 MB Time elapsed: 3 s ***** [DM] Iteration 18/41 (scale 0.00042913890353962997) ***** [1] xi(17)=0.0003796809648784362 xi_scaled(17)=0.8847507456134738 zeta(18)=4.43434579197502e-08 Stats: nr=26 min=1 max=92 Emax=8.797342588944039 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 66 MB Time elapsed: 3 s ***** [DM] Iteration 19/41 (scale 0.000271411273554505) ***** [1] xi(18)=0.0003019307862626538 xi_scaled(18)=1.11244747614369 zeta(19)=8.302025336957366e-08 Stats: nr=31 min=1 max=100 Emax=9.725726155966431 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 67 MB Time elapsed: 3 s ***** [DM] Iteration 20/41 (scale 0.00017165556141585201) ***** [1] xi(19)=0.000151885934459659 xi_scaled(19)=0.8848296740686474 zeta(20)=8.166918626862049e-09 Stats: nr=26 min=1 max=92 Emax=8.796484971779618 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 67 MB Time elapsed: 3 s ***** [DM] Iteration 21/41 (scale 0.000108564509421802) ***** [1] xi(20)=0.0001207615082744172 xi_scaled(20)=1.112347938728546 zeta(21)=1.567915093485497e-08 Stats: nr=31 min=1 max=100 Emax=9.732541109677509 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 67 MB Time elapsed: 3 s ***** [DM] Iteration 22/41 (scale 6.8662224566340798e-05) ***** [1] xi(21)=6.077583131409551e-05 xi_scaled(21)=0.885142182589416 zeta(22)=1.530423685655877e-09 Stats: nr=26 min=1 max=92 Emax=8.795886716335719 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 67 MB Time elapsed: 3 s ***** [DM] Iteration 23/41 (scale 4.3425803768720796e-05) ***** [1] xi(22)=4.82875430623737e-05 xi_scaled(22)=1.111955079048065 zeta(23)=2.985749262629318e-09 Stats: nr=31 min=1 max=100 Emax=9.732330117308823 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 67 MB Time elapsed: 3 s ***** [DM] Iteration 24/41 (scale 2.7464889826536317e-05) ***** [1] xi(23)=2.434418086741709e-05 xi_scaled(23)=0.8863746048562691 zeta(24)=2.979238371939102e-10 Stats: nr=26 min=1 max=92 Emax=8.795494627208628 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 68 MB Time elapsed: 3 s ***** [DM] Iteration 25/41 (scale 1.7370321507488318e-05) ***** [1] xi(24)=1.928818977819493e-05 xi_scaled(24)=1.110410637470344 zeta(25)=5.726842489390972e-10 Stats: nr=31 min=1 max=100 Emax=9.732174913573115 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 68 MB Time elapsed: 3 s ***** [DM] Iteration 26/41 (scale 1.0985955930614528e-05) ***** [1] xi(25)=9.790631478312447e-06 xi_scaled(25)=0.8911952259911152 zeta(26)=6.598910873030082e-11 Stats: nr=26 min=1 max=92 Emax=8.795248244402417 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 68 MB Time elapsed: 3 s ***** [DM] Iteration 27/41 (scale 6.948128602995327e-06) ***** [1] xi(26)=7.673894917665424e-06 xi_scaled(26)=1.10445493400298 zeta(27)=1.11591054983396e-10 Stats: nr=31 min=1 max=100 Emax=9.731980772855403 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 68 MB Time elapsed: 3 s ***** [DM] Iteration 28/41 (scale 4.3943823722458113e-06) ***** [1] xi(27)=3.996177096961947e-06 xi_scaled(27)=0.9093831074421601 zeta(28)=2.159128539198777e-11 Stats: nr=26 min=1 max=92 Emax=8.795110039534247 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 69 MB Time elapsed: 3 s ***** [DM] Iteration 29/41 (scale 2.7792514411981313e-06) ***** [1] xi(28)=3.011534759762334e-06 xi_scaled(28)=1.083577655163171 zeta(29)=2.421397699290939e-11 Stats: nr=31 min=1 max=100 Emax=9.672288532975539 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 69 MB Time elapsed: 3 s ***** [DM] Iteration 30/41 (scale 1.7577529488983243e-06) ***** [1] xi(29)=1.701057314970183e-06 xi_scaled(29)=0.967745391089416 zeta(30)=1.264336754233646e-11 Stats: nr=26 min=1 max=92 Emax=8.795075945779294 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 69 MB Time elapsed: 3 s ***** [DM] Iteration 31/41 (scale 1.1117005764792524e-06) ***** [1] xi(30)=1.156716176923296e-06 xi_scaled(30)=1.040492558334914 zeta(31)=9.267732313449569e-12 Stats: nr=31 min=1 max=100 Emax=9.49703888405676 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 69 MB Time elapsed: 3 s ***** [DM] Iteration 32/41 (scale 7.0310117955932977e-07) ***** [1] xi(31)=7.533529377612041e-07 xi_scaled(31)=1.071471588532065 zeta(32)=1.021618393321195e-11 Stats: nr=26 min=1 max=92 Safeguard: keep additional 1 states Emax=8.795124752186702 nrkept=201 nrkeptmult=501 Kept: 201 out of 756, ratio=0.266 Memory used: 70 MB Time elapsed: 3 s ***** [DM] Iteration 33/41 (scale 4.4468023059170098e-07) ***** [1] xi(32)=4.8438824160062e-07 xi_scaled(32)=1.089295651745261 zeta(33)=8.52970028771494e-12 Stats: nr=31 min=1 max=101 Emax=9.44599614538256 nrkept=200 nrkeptmult=490 Kept: 200 out of 759, ratio=0.264 Memory used: 70 MB Time elapsed: 3 s ***** [DM] Iteration 34/41 (scale 2.8124047182373188e-07) ***** [1] xi(33)=3.115993810360347e-07 xi_scaled(33)=1.107946445315773 zeta(34)=9.713349214836401e-12 Stats: nr=26 min=1 max=92 Emax=8.79499139897961 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 70 MB Time elapsed: 3 s ***** [DM] Iteration 35/41 (scale 1.7787209223668039e-07) ***** [1] xi(34)=1.978022480351426e-07 xi_scaled(34)=1.112047682960533 zeta(35)=1.013504265026389e-11 Stats: nr=31 min=1 max=100 Emax=9.445812662973866 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 70 MB Time elapsed: 3 s ***** [DM] Iteration 36/41 (scale 1.1249618872949276e-07) ***** [1] xi(35)=1.251423123720037e-07 xi_scaled(35)=1.112413796283531 zeta(36)=9.110773847422819e-12 Stats: nr=26 min=1 max=92 Emax=8.794824773709632 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 71 MB Time elapsed: 3 s ***** [DM] Iteration 37/41 (scale 7.1148836894672156e-08) ***** [1] xi(36)=7.912894395889384e-08 xi_scaled(36)=1.11216075219944 zeta(37)=1.33165944395657e-11 Stats: nr=31 min=1 max=100 Emax=9.445011981948545 nrkept=200 nrkeptmult=490 Kept: 200 out of 755, ratio=0.265 Memory used: 71 MB Time elapsed: 3 s ***** [DM] Iteration 38/41 (scale 4.4998475491797109e-08) ***** [1] xi(37)=5.005030476578071e-08 xi_scaled(37)=1.112266676121161 zeta(38)=7.783756654266801e-12 Stats: nr=26 min=1 max=92 Emax=8.794213436690764 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 71 MB Time elapsed: 4 s ***** [DM] Iteration 39/41 (scale 2.8459534757868861e-08) ***** [1] xi(38)=3.163920723005588e-08 xi_scaled(38)=1.111726087556925 zeta(39)=1.516129607114603e-11 Stats: nr=31 min=1 max=100 Emax=9.443415773378712 nrkept=200 nrkeptmult=492 Kept: 200 out of 755, ratio=0.265 Memory used: 72 MB Time elapsed: 4 s ***** [DM] Iteration 40/41 (scale 1.7999390196718842e-08) ***** [1] xi(39)=2.001023075815577e-08 xi_scaled(39)=1.111717149273395 zeta(40)=6.612753688881832e-12 Stats: nr=26 min=1 max=92 Emax=8.792678115959092 nrkept=200 nrkeptmult=499 Kept: 200 out of 756, ratio=0.265 Memory used: 72 MB Time elapsed: 4 s ***** [DM] Iteration 41/41 (scale 1.1383813903147544e-08) ***** [1] xi(40)=1.264912630733812e-08 xi_scaled(40)=1.111150130787075 zeta(41)=9.216575161210059e-12 Stats: nr=31 min=1 max=100 Emax=9.440677142774934 nrkept=755 nrkeptmult=1996 Kept: 755 out of 755, ratio=1 Memory used: 72 MB Time elapsed: 4 s ** Iteration completed. Spectrum: A_d-A_d FDM [A_d-A_d] pos=0.50329093560236 neg=0.4967090643976053 sum= 0.9999999999999654 mu1=0.09819161412414913 mu2=0.08530686239122709 mu3=0.01881632165617241 mu4=0.01974061215351367 f=0.5032909356023727 b=0.5032909356023022 Spectrum: self_d-A_d FDM [self_d-A_d] pos=0.1677732668230162 neg=-0.06941873462421487 sum= 0.09835453219880129 mu1=0.07232044018171817 mu2=0.02079447971157092 mu3=0.01098909113997168 mu4=0.003953407790484965 f=0.1677732668230155 b=0.1677732668230193 Memory usage report =================== after diag: 74052 kB after recalc: 74236 kB after split: 74052 kB after trim: 74236 kB after trunc: 74052 kB diag_h: 62884 kB Peak usage: 74236 kB Timing report ============= All: 4 s DM: 0 s FDM: 0 s diag: 0 s recalc d: 0 s spec d: 0 s Other: 1 s