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=0.5 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 0.08888000783654434 (-1 2) 2 states 0.0225727299124085 0.1002566713272746 (0 1) 3 states 0 0.08888000783654428 0.1228294012396831 (0 3) 1 states 0.03394939340313878 (1 2) 2 states 0.02257272991240838 0.1002566713272746 (2 1) 1 states 0.08888000783654421 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 10.510537250399226) ***** [1] xi(0)=1.528133495393713 xi_scaled(0)=0.1453906169578219 zeta(1)=2.822080309108428e-14 Stats: nr=10 min=1 max=8 Emax=0.69568459248925 nrkept=35 nrkeptmult=64 Total energy=-4.156009411943532 Egs=-0.2414689144394275 Kept: 35 out of 35, ratio=1 =1 Memory used: 1 MB Time elapsed: 0 s ***** [NRG] Iteration 2/38 (scale 6.0682615108455824) ***** [1] xi(1)=2.683111701942137 xi_scaled(1)=0.4421549231434257 zeta(2)=-2.109300283531763e-13 Stats: nr=15 min=1 max=20 Emax=2.370994973411043 nrkept=126 nrkeptmult=256 Total energy=-7.693908769779289 Egs=-0.5830169565884065 Kept: 126 out of 126, ratio=1 =0.9999999999999996 Memory used: 2 MB Time elapsed: 0 s ***** [NRG] Iteration 3/38 (scale 3.503512416799742) ***** [1] xi(2)=4.255087605920855 xi_scaled(2)=1.214520486788408 zeta(3)=-9.946957551165347e-13 Stats: nr=21 min=1 max=75 Emax=7.62668652356757 nrkept=462 nrkeptmult=1024 Total energy=-13.86009546717911 Egs=-1.76000138256461 Kept: 462 out of 462, ratio=1 =0.9999999999999993 Memory used: 3 MB Time elapsed: 0 s ***** [NRG] Iteration 4/38 (scale 2.0227538369485276) ***** [1] xi(3)=7.172509170095084 xi_scaled(3)=3.545913021683023 zeta(4)=2.194245937260392e-13 Stats: nr=28 min=1 max=210 Safeguard: keep additional 7 states Emax=8.254143359555489 nrkept=420 nrkeptmult=976 Total energy=-23.87687209969447 Egs=-4.95204925559622 Kept: 420 out of 1716, ratio=0.245 =0.9999999999999993 Memory used: 8 MB Time elapsed: 0 s ***** [NRG] Iteration 5/38 (scale 1.167837472266581) ***** [1] xi(4)=7.2435744731663 xi_scaled(4)=6.202553561762074 zeta(5)=9.313715778298269e-13 Stats: nr=33 min=1 max=205 Safeguard: keep additional 2 states Emax=9.702738196539066 nrkept=202 nrkeptmult=448 Total energy=-32.32595780914924 Egs=-7.234812985625894 Kept: 202 out of 1570, ratio=0.129 =0.9999999999999983 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 6/38 (scale 0.67425127898284254) ***** [1] xi(5)=1.631362736234078 xi_scaled(5)=2.419517451557687 zeta(6)=3.757641463303937e-14 Stats: nr=26 min=1 max=93 Safeguard: keep additional 1 states Emax=10.17402513559868 nrkept=201 nrkeptmult=449 Total energy=-33.35118519954753 Egs=-1.520542003190432 Kept: 201 out of 752, ratio=0.267 =0.9999999999999966 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 7/38 (scale 0.38927915742219354) ***** [1] xi(6)=0.3639340314408619 xi_scaled(6)=0.9348921577277164 zeta(7)=5.306910059469691e-15 Stats: nr=27 min=1 max=112 Safeguard: keep additional 1 states Emax=9.78063663710827 nrkept=201 nrkeptmult=458 Total energy=-33.77737348552525 Egs=-1.094814037309193 Kept: 201 out of 750, ratio=0.268 =0.9999999999999946 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 8/38 (scale 0.22475042632761416) ***** [1] xi(7)=0.3396444160757234 xi_scaled(7)=1.511206993577092 zeta(8)=-1.019580269785106e-14 Stats: nr=26 min=1 max=93 Emax=10.75481939328656 nrkept=200 nrkeptmult=448 Total energy=-34.20686876446126 Egs=-1.910987605024355 Kept: 200 out of 752, ratio=0.266 =0.9999999999999947 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 9/38 (scale 0.1297597191407312) ***** [1] xi(8)=0.184759350367929 xi_scaled(8)=1.423857508257611 zeta(9)=-3.153345972744822e-15 Stats: nr=27 min=1 max=111 Emax=11.83972392317693 nrkept=200 nrkeptmult=466 Total energy=-34.37973100633577 Egs=-1.332171825118093 Kept: 200 out of 746, ratio=0.268 =0.9999999999999939 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 10/38 (scale 0.074916808775871396) ***** [1] xi(9)=0.104296759093593 xi_scaled(9)=1.392167669683016 zeta(10)=-1.203467749686133e-15 Stats: nr=26 min=1 max=93 Emax=12.34216723110789 nrkept=200 nrkeptmult=498 Total energy=-34.51533366852254 Egs=-1.810043225311986 Kept: 200 out of 750, ratio=0.267 =0.999999999999992 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 11/38 (scale 0.043253239713577071) ***** [1] xi(10)=0.05539314793478626 xi_scaled(10)=1.280670495472701 zeta(11)=-3.410853316478054e-16 Stats: nr=31 min=1 max=99 Safeguard: keep additional 1 states Emax=12.93156687360787 nrkept=201 nrkeptmult=474 Total energy=-34.55946200107136 Egs=-1.020231844852302 Kept: 201 out of 755, ratio=0.266 =0.9999999999999923 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 12/38 (scale 0.024972269591957134) ***** [1] xi(11)=0.03099795980478091 xi_scaled(11)=1.241295257150535 zeta(12)=-7.571242021221899e-17 Stats: nr=26 min=1 max=91 Safeguard: keep additional 1 states Emax=13.06671924813927 nrkept=201 nrkeptmult=481 Total energy=-34.60572506597227 Egs=-1.852577505242483 Kept: 201 out of 752, ratio=0.267 =0.9999999999999911 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 13/38 (scale 0.014417746571192356) ***** [1] xi(12)=0.01742078955655347 xi_scaled(12)=1.208287957520449 zeta(13)=-3.911687530202712e-17 Stats: nr=29 min=1 max=104 Emax=13.71509877162317 nrkept=200 nrkeptmult=464 Total energy=-34.61786213007645 Egs=-0.8418142214007887 Kept: 200 out of 757, ratio=0.264 =0.9999999999999922 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 14/38 (scale 0.0083240898639857092) ***** [1] xi(13)=0.009984013962235569 xi_scaled(13)=1.199412082927113 zeta(14)=-1.328721478154342e-17 Stats: nr=26 min=1 max=93 Safeguard: keep additional 4 states Emax=14.54409217885313 nrkept=204 nrkeptmult=468 Total energy=-34.63415850993122 Egs=-1.957737136557127 Kept: 204 out of 748, ratio=0.273 =0.9999999999999923 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 15/38 (scale 0.0048059155237307853) ***** [1] xi(14)=0.005732617756115454 xi_scaled(14)=1.192825326997275 zeta(15)=-5.957821052053217e-18 Stats: nr=29 min=1 max=109 Safeguard: keep additional 3 states Emax=14.7239264366892 nrkept=203 nrkeptmult=456 Total energy=-34.63789786043802 Egs=-0.7780724584819241 Kept: 203 out of 762, ratio=0.266 =0.9999999999999928 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 16/38 (scale 0.0027746966213285699) ***** [1] xi(15)=0.003303234036189205 xi_scaled(15)=1.190484758152609 zeta(16)=-2.708677843952084e-18 Stats: nr=26 min=1 max=94 Safeguard: keep additional 1 states Emax=15.52686384264525 nrkept=201 nrkeptmult=449 Total energy=-34.64348229682306 Egs=-2.012629540147776 Kept: 201 out of 756, ratio=0.266 =0.9999999999999937 Memory used: 9 MB Time elapsed: 0 s ***** [NRG] Iteration 17/38 (scale 0.0016019718412435954) ***** [1] xi(16)=0.001905331424797448 xi_scaled(16)=1.189366364466405 zeta(17)=-6.77563647116122e-19 Stats: nr=27 min=1 max=112 Emax=14.51857784389884 nrkept=200 nrkeptmult=440 Total energy=-34.64469511326547 Egs=-0.7570772539129901 Kept: 200 out of 750, ratio=0.267 =0.9999999999999942 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 18/38 (scale 0.00092489887377619003) ***** [1] xi(17)=0.001099664297865248 xi_scaled(17)=1.188956251374297 zeta(18)=-2.602132364508227e-19 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=15.97053070956651 nrkept=201 nrkeptmult=449 Total energy=-34.64657654151832 Egs=-2.034198879677825 Kept: 201 out of 744, ratio=0.27 =0.9999999999999919 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 19/38 (scale 0.00053399061374786506) ***** [1] xi(18)=0.000634808110584735 xi_scaled(18)=1.188800129143231 zeta(19)=-4.011130950893221e-20 Stats: nr=27 min=1 max=112 Emax=14.42210435061146 nrkept=200 nrkeptmult=440 Total energy=-34.6469772787616 Egs=-0.7504574667853789 Kept: 200 out of 750, ratio=0.267 =0.9999999999999932 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 20/38 (scale 0.00030829962459206334) ***** [1] xi(19)=0.0003664923088387387 xi_scaled(19)=1.188753665605902 zeta(20)=-1.333584913982075e-20 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.10208888835423 nrkept=201 nrkeptmult=449 Total energy=-34.64760678595231 Egs=-2.041868171377813 Kept: 201 out of 744, ratio=0.27 =0.9999999999999917 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 21/38 (scale 0.00017799687124928835) ***** [1] xi(20)=0.0002115906318566231 xi_scaled(20)=1.188732309571251 zeta(21)=8.127468179273535e-22 Stats: nr=27 min=1 max=112 Emax=14.3869964008373 nrkept=200 nrkeptmult=440 Total energy=-34.64773998753713 Egs=-0.7483366639611919 Kept: 200 out of 750, ratio=0.267 =0.9999999999999926 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 22/38 (scale 0.00010276654153068778) ***** [1] xi(21)=0.0001221614239718277 xi_scaled(21)=1.188727597058896 zeta(22)=4.816220180592398e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.14334146222234 nrkept=201 nrkeptmult=449 Total energy=-34.64795009141261 Egs=-2.044477437409484 Kept: 201 out of 744, ratio=0.27 =0.9999999999999929 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 23/38 (scale 5.9332290416429444e-05) ***** [1] xi(22)=7.052970330879003e-05 xi_scaled(22)=1.188723759250999 zeta(23)=1.748376820115055e-22 Stats: nr=27 min=1 max=112 Emax=14.37518147946877 nrkept=200 nrkeptmult=440 Total energy=-34.64799445065659 Egs=-0.7476408489381966 Kept: 200 out of 750, ratio=0.267 =0.9999999999999934 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 24/38 (scale 3.4255513843562592e-05) ***** [1] xi(23)=4.072032779977907e-05 xi_scaled(23)=1.188723309938945 zeta(24)=1.335229529101013e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.15698878239698 nrkept=201 nrkeptmult=449 Total energy=-34.64806451522967 Egs=-2.045351688514012 Kept: 201 out of 744, ratio=0.27 =0.9999999999999927 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 25/38 (scale 1.9777430138809818e-05) ***** [1] xi(24)=2.350987235783331e-05 xi_scaled(24)=1.188722305821686 zeta(25)=-4.753511569586405e-22 Stats: nr=27 min=1 max=112 Emax=14.3712181026735 nrkept=200 nrkeptmult=440 Total energy=-34.64807929708789 Egs=-0.7474104631548513 Kept: 200 out of 750, ratio=0.267 =0.9999999999999928 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 26/38 (scale 1.1418504614520865e-05) ***** [1] xi(25)=1.357343210385269e-05 xi_scaled(25)=1.188722390722811 zeta(26)=5.35841316781969e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16113799900566 nrkept=201 nrkeptmult=443 Total energy=-34.64810265527562 Egs=-2.045643323728913 Kept: 201 out of 744, ratio=0.27 =0.9999999999999942 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 27/38 (scale 6.5924767129366052e-06) ***** [1] xi(26)=7.836621556599078e-06 xi_scaled(26)=1.188721917093928 zeta(27)=-6.262278240412776e-22 Stats: nr=27 min=1 max=112 Emax=14.36988533854026 nrkept=200 nrkeptmult=440 Total energy=-34.64810758205692 Egs=-0.7473338957111425 Kept: 200 out of 747, ratio=0.268 =0.9999999999999919 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 28/38 (scale 3.806168204840288e-06) ***** [1] xi(27)=4.524476969706999e-06 xi_scaled(27)=1.188722286091624 zeta(28)=7.113722432178661e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16277231145412 nrkept=201 nrkeptmult=443 Total energy=-34.6481153684903 Egs=-2.045740745350886 Kept: 201 out of 744, ratio=0.27 =0.9999999999999929 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 29/38 (scale 2.1974922376455351e-06) ***** [1] xi(28)=2.612206707611321e-06 xi_scaled(28)=1.18872169960888 zeta(29)=-5.847228341456885e-22 Stats: nr=27 min=1 max=112 Emax=14.36943724888703 nrkept=200 nrkeptmult=440 Total energy=-34.64811701069436 Egs=-0.7473082418885918 Kept: 200 out of 747, ratio=0.268 =0.9999999999999927 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 30/38 (scale 1.2687227349467627e-06) ***** [1] xi(29)=1.508159277097662e-06 xi_scaled(29)=1.188722512457339 zeta(30)=4.548538430357476e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16341746697248 nrkept=201 nrkeptmult=443 Total energy=-34.64811960621402 Egs=-2.045773742299121 Kept: 201 out of 744, ratio=0.27 =0.9999999999999915 Memory used: 10 MB Time elapsed: 0 s ***** [NRG] Iteration 31/38 (scale 7.3249741254851165e-07) ***** [1] xi(30)=8.707358921095715e-07 xi_scaled(30)=1.188722140437465 zeta(31)=-2.58529047468897e-22 Stats: nr=27 min=1 max=112 Emax=14.36928807014726 nrkept=200 nrkeptmult=440 Total energy=-34.64812015360943 Egs=-0.7473001207387585 Kept: 200 out of 747, ratio=0.268 =0.9999999999999923 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 32/38 (scale 4.2290757831558756e-07) ***** [1] xi(31)=5.0271957042629e-07 xi_scaled(31)=1.188722066482204 zeta(32)=-1.723155245733509e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 2 states Emax=16.16365007147575 nrkept=202 nrkeptmult=446 Total energy=-34.64812101878685 Egs=-2.045783693834525 Kept: 202 out of 744, ratio=0.272 =0.9999999999999929 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 33/38 (scale 2.4416580418283722e-07) ***** [1] xi(32)=2.902452492378336e-07 xi_scaled(32)=1.188721943309027 zeta(33)=-6.010662624928327e-23 Stats: nr=27 min=1 max=113 Emax=14.3692409017749 nrkept=200 nrkeptmult=440 Total energy=-34.64812120125131 Egs=-0.7472973323075586 Kept: 200 out of 751, ratio=0.266 =0.9999999999999929 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 34/38 (scale 1.4096919277186254e-07) ***** [1] xi(33)=1.675731612529305e-07 xi_scaled(33)=1.188721861549725 zeta(34)=-1.987552984653991e-23 Stats: nr=25 min=2 max=94 Safeguard: keep additional 2 states Emax=16.16372187883543 nrkept=202 nrkeptmult=446 Total energy=-34.64812148964423 Egs=-2.045786838717055 Kept: 202 out of 744, ratio=0.272 =0.9999999999999925 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 35/38 (scale 8.1388601394279077e-08) ***** [1] xi(34)=9.67484059526414e-08 xi_scaled(34)=1.188721814790173 zeta(35)=-6.61632548445088e-24 Stats: nr=27 min=1 max=113 Emax=14.36922027963973 nrkept=200 nrkeptmult=440 Total energy=-34.64812155046563 Egs=-0.7472963955266371 Kept: 200 out of 751, ratio=0.266 =0.999999999999992 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 36/38 (scale 4.6989730923954179e-08) ***** [1] xi(35)=5.585771856591841e-08 xi_scaled(35)=1.188721822142709 zeta(36)=-2.205324682068829e-24 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16376332041628 nrkept=225 nrkeptmult=491 Total energy=-34.64812164659666 Egs=-2.045787915570552 Kept: 225 out of 744, ratio=0.302 =0.9999999999999931 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 37/38 (scale 2.7129533798093027e-08) ***** [1] xi(36)=3.224946699826806e-08 xi_scaled(36)=1.188721753874551 zeta(37)=-7.351076416083485e-25 Stats: nr=29 min=1 max=120 Emax=14.36921202632076 nrkept=200 nrkeptmult=440 Total energy=-34.64812166687045 Egs=-0.7472960583407133 Kept: 200 out of 831, ratio=0.241 =0.9999999999999923 Memory used: 10 MB Time elapsed: 1 s ***** [NRG] Iteration 38/38 (scale 1.566324364131806e-08) ***** [1] xi(37)=1.861923863088457e-08 xi_scaled(37)=1.188721765252307 zeta(38)=-2.45035905824832e-25 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16375705163269 nrkept=744 nrkeptmult=1760 Total energy=-34.64812169891413 Egs=-2.045788206039141 Kept: 744 out of 744, ratio=1 =0.9999999999999906 Memory used: 10 MB Time elapsed: 1 s ** Iteration completed. Total energy: -34.64812169891413 TKW=0.02857456071315219 Grand canonical Z= 2.289422186701131 Zft (last shell)= 2.289422202781423 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 0.08888000783654434 (-1 2) 2 states 0.0225727299124085 0.1002566713272746 (0 1) 3 states 0 0.08888000783654428 0.1228294012396831 (0 3) 1 states 0.03394939340313878 (1 2) 2 states 0.02257272991240838 0.1002566713272746 (2 1) 1 states 0.08888000783654421 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 10.510537250399226) ***** [1] xi(0)=1.528133495393713 xi_scaled(0)=0.1453906169578219 zeta(1)=2.822080309108428e-14 Stats: nr=10 min=1 max=8 Emax=0.69568459248925 nrkept=35 nrkeptmult=64 Kept: 35 out of 35, ratio=1 Memory used: 12 MB Time elapsed: 1 s ***** [DM] Iteration 2/38 (scale 6.0682615108455824) ***** [1] xi(1)=2.683111701942137 xi_scaled(1)=0.4421549231434257 zeta(2)=-2.109300283531763e-13 Stats: nr=15 min=1 max=20 Emax=2.370994973411043 nrkept=126 nrkeptmult=256 Kept: 126 out of 126, ratio=1 Memory used: 12 MB Time elapsed: 1 s ***** [DM] Iteration 3/38 (scale 3.503512416799742) ***** [1] xi(2)=4.255087605920855 xi_scaled(2)=1.214520486788408 zeta(3)=-9.946957551165347e-13 Stats: nr=21 min=1 max=75 Emax=7.62668652356757 nrkept=462 nrkeptmult=1024 Kept: 462 out of 462, ratio=1 Memory used: 12 MB Time elapsed: 1 s ***** [DM] Iteration 4/38 (scale 2.0227538369485276) ***** [1] xi(3)=7.172509170095084 xi_scaled(3)=3.545913021683023 zeta(4)=2.194245937260392e-13 Stats: nr=28 min=1 max=210 Safeguard: keep additional 7 states Emax=8.254143359555489 nrkept=420 nrkeptmult=976 Kept: 420 out of 1716, ratio=0.245 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 5/38 (scale 1.167837472266581) ***** [1] xi(4)=7.2435744731663 xi_scaled(4)=6.202553561762074 zeta(5)=9.313715778298269e-13 Stats: nr=33 min=1 max=205 Safeguard: keep additional 2 states Emax=9.702738196539066 nrkept=202 nrkeptmult=448 Kept: 202 out of 1570, ratio=0.129 Memory used: 14 MB Time elapsed: 2 s ***** [DM] Iteration 6/38 (scale 0.67425127898284254) ***** [1] xi(5)=1.631362736234078 xi_scaled(5)=2.419517451557687 zeta(6)=3.757641463303937e-14 Stats: nr=26 min=1 max=93 Safeguard: keep additional 1 states Emax=10.17402513559868 nrkept=201 nrkeptmult=449 Kept: 201 out of 752, ratio=0.267 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 7/38 (scale 0.38927915742219354) ***** [1] xi(6)=0.3639340314408619 xi_scaled(6)=0.9348921577277164 zeta(7)=5.306910059469691e-15 Stats: nr=27 min=1 max=112 Safeguard: keep additional 1 states Emax=9.78063663710827 nrkept=201 nrkeptmult=458 Kept: 201 out of 750, ratio=0.268 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 8/38 (scale 0.22475042632761416) ***** [1] xi(7)=0.3396444160757234 xi_scaled(7)=1.511206993577092 zeta(8)=-1.019580269785106e-14 Stats: nr=26 min=1 max=93 Emax=10.75481939328656 nrkept=200 nrkeptmult=448 Kept: 200 out of 752, ratio=0.266 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 9/38 (scale 0.1297597191407312) ***** [1] xi(8)=0.184759350367929 xi_scaled(8)=1.423857508257611 zeta(9)=-3.153345972744822e-15 Stats: nr=27 min=1 max=111 Emax=11.83972392317693 nrkept=200 nrkeptmult=466 Kept: 200 out of 746, ratio=0.268 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 10/38 (scale 0.074916808775871396) ***** [1] xi(9)=0.104296759093593 xi_scaled(9)=1.392167669683016 zeta(10)=-1.203467749686133e-15 Stats: nr=26 min=1 max=93 Emax=12.34216723110789 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 0.043253239713577071) ***** [1] xi(10)=0.05539314793478626 xi_scaled(10)=1.280670495472701 zeta(11)=-3.410853316478054e-16 Stats: nr=31 min=1 max=99 Safeguard: keep additional 1 states Emax=12.93156687360787 nrkept=201 nrkeptmult=474 Kept: 201 out of 755, ratio=0.266 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 12/38 (scale 0.024972269591957134) ***** [1] xi(11)=0.03099795980478091 xi_scaled(11)=1.241295257150535 zeta(12)=-7.571242021221899e-17 Stats: nr=26 min=1 max=91 Safeguard: keep additional 1 states Emax=13.06671924813927 nrkept=201 nrkeptmult=481 Kept: 201 out of 752, ratio=0.267 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 13/38 (scale 0.014417746571192356) ***** [1] xi(12)=0.01742078955655347 xi_scaled(12)=1.208287957520449 zeta(13)=-3.911687530202712e-17 Stats: nr=29 min=1 max=104 Emax=13.71509877162317 nrkept=200 nrkeptmult=464 Kept: 200 out of 757, ratio=0.264 Memory used: 15 MB Time elapsed: 2 s ***** [DM] Iteration 14/38 (scale 0.0083240898639857092) ***** [1] xi(13)=0.009984013962235569 xi_scaled(13)=1.199412082927113 zeta(14)=-1.328721478154342e-17 Stats: nr=26 min=1 max=93 Safeguard: keep additional 4 states Emax=14.54409217885313 nrkept=204 nrkeptmult=468 Kept: 204 out of 748, ratio=0.273 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 15/38 (scale 0.0048059155237307853) ***** [1] xi(14)=0.005732617756115454 xi_scaled(14)=1.192825326997275 zeta(15)=-5.957821052053217e-18 Stats: nr=29 min=1 max=109 Safeguard: keep additional 3 states Emax=14.7239264366892 nrkept=203 nrkeptmult=456 Kept: 203 out of 762, ratio=0.266 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 16/38 (scale 0.0027746966213285699) ***** [1] xi(15)=0.003303234036189205 xi_scaled(15)=1.190484758152609 zeta(16)=-2.708677843952084e-18 Stats: nr=26 min=1 max=94 Safeguard: keep additional 1 states Emax=15.52686384264525 nrkept=201 nrkeptmult=449 Kept: 201 out of 756, ratio=0.266 Memory used: 16 MB Time elapsed: 2 s ***** [DM] Iteration 17/38 (scale 0.0016019718412435954) ***** [1] xi(16)=0.001905331424797448 xi_scaled(16)=1.189366364466405 zeta(17)=-6.77563647116122e-19 Stats: nr=27 min=1 max=112 Emax=14.51857784389884 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 0.00092489887377619003) ***** [1] xi(17)=0.001099664297865248 xi_scaled(17)=1.188956251374297 zeta(18)=-2.602132364508227e-19 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=15.97053070956651 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 0.00053399061374786506) ***** [1] xi(18)=0.000634808110584735 xi_scaled(18)=1.188800129143231 zeta(19)=-4.011130950893221e-20 Stats: nr=27 min=1 max=112 Emax=14.42210435061146 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 17 MB Time elapsed: 2 s ***** [DM] Iteration 20/38 (scale 0.00030829962459206334) ***** [1] xi(19)=0.0003664923088387387 xi_scaled(19)=1.188753665605902 zeta(20)=-1.333584913982075e-20 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.10208888835423 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 0.00017799687124928835) ***** [1] xi(20)=0.0002115906318566231 xi_scaled(20)=1.188732309571251 zeta(21)=8.127468179273535e-22 Stats: nr=27 min=1 max=112 Emax=14.3869964008373 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 0.00010276654153068778) ***** [1] xi(21)=0.0001221614239718277 xi_scaled(21)=1.188727597058896 zeta(22)=4.816220180592398e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.14334146222234 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 5.9332290416429444e-05) ***** [1] xi(22)=7.052970330879003e-05 xi_scaled(22)=1.188723759250999 zeta(23)=1.748376820115055e-22 Stats: nr=27 min=1 max=112 Emax=14.37518147946877 nrkept=200 nrkeptmult=440 Kept: 200 out of 750, ratio=0.267 Memory used: 18 MB Time elapsed: 2 s ***** [DM] Iteration 24/38 (scale 3.4255513843562592e-05) ***** [1] xi(23)=4.072032779977907e-05 xi_scaled(23)=1.188723309938945 zeta(24)=1.335229529101013e-21 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.15698878239698 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 1.9777430138809818e-05) ***** [1] xi(24)=2.350987235783331e-05 xi_scaled(24)=1.188722305821686 zeta(25)=-4.753511569586405e-22 Stats: nr=27 min=1 max=112 Emax=14.3712181026735 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 1.1418504614520865e-05) ***** [1] xi(25)=1.357343210385269e-05 xi_scaled(25)=1.188722390722811 zeta(26)=5.35841316781969e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16113799900566 nrkept=201 nrkeptmult=443 Kept: 201 out of 744, ratio=0.27 Memory used: 18 MB Time elapsed: 2 s ***** [DM] Iteration 27/38 (scale 6.5924767129366052e-06) ***** [1] xi(26)=7.836621556599078e-06 xi_scaled(26)=1.188721917093928 zeta(27)=-6.262278240412776e-22 Stats: nr=27 min=1 max=112 Emax=14.36988533854026 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 3.806168204840288e-06) ***** [1] xi(27)=4.524476969706999e-06 xi_scaled(27)=1.188722286091624 zeta(28)=7.113722432178661e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16277231145412 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 2.1974922376455351e-06) ***** [1] xi(28)=2.612206707611321e-06 xi_scaled(28)=1.18872169960888 zeta(29)=-5.847228341456885e-22 Stats: nr=27 min=1 max=112 Emax=14.36943724888703 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 1.2687227349467627e-06) ***** [1] xi(29)=1.508159277097662e-06 xi_scaled(29)=1.188722512457339 zeta(30)=4.548538430357476e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 1 states Emax=16.16341746697248 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 7.3249741254851165e-07) ***** [1] xi(30)=8.707358921095715e-07 xi_scaled(30)=1.188722140437465 zeta(31)=-2.58529047468897e-22 Stats: nr=27 min=1 max=112 Emax=14.36928807014726 nrkept=200 nrkeptmult=440 Kept: 200 out of 747, ratio=0.268 Memory used: 19 MB Time elapsed: 2 s ***** [DM] Iteration 32/38 (scale 4.2290757831558756e-07) ***** [1] xi(31)=5.0271957042629e-07 xi_scaled(31)=1.188722066482204 zeta(32)=-1.723155245733509e-22 Stats: nr=25 min=2 max=94 Safeguard: keep additional 2 states Emax=16.16365007147575 nrkept=202 nrkeptmult=446 Kept: 202 out of 744, ratio=0.272 Memory used: 20 MB Time elapsed: 3 s ***** [DM] Iteration 33/38 (scale 2.4416580418283722e-07) ***** [1] xi(32)=2.902452492378336e-07 xi_scaled(32)=1.188721943309027 zeta(33)=-6.010662624928327e-23 Stats: nr=27 min=1 max=113 Emax=14.3692409017749 nrkept=200 nrkeptmult=440 Kept: 200 out of 751, ratio=0.266 Memory used: 20 MB Time elapsed: 3 s ***** [DM] Iteration 34/38 (scale 1.4096919277186254e-07) ***** [1] xi(33)=1.675731612529305e-07 xi_scaled(33)=1.188721861549725 zeta(34)=-1.987552984653991e-23 Stats: nr=25 min=2 max=94 Safeguard: keep additional 2 states Emax=16.16372187883543 nrkept=202 nrkeptmult=446 Kept: 202 out of 744, ratio=0.272 Memory used: 20 MB Time elapsed: 3 s ***** [DM] Iteration 35/38 (scale 8.1388601394279077e-08) ***** [1] xi(34)=9.67484059526414e-08 xi_scaled(34)=1.188721814790173 zeta(35)=-6.61632548445088e-24 Stats: nr=27 min=1 max=113 Emax=14.36922027963973 nrkept=200 nrkeptmult=440 Kept: 200 out of 751, ratio=0.266 Memory used: 20 MB Time elapsed: 3 s ***** [DM] Iteration 36/38 (scale 4.6989730923954179e-08) ***** [1] xi(35)=5.585771856591841e-08 xi_scaled(35)=1.188721822142709 zeta(36)=-2.205324682068829e-24 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16376332041628 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 2.7129533798093027e-08) ***** [1] xi(36)=3.224946699826806e-08 xi_scaled(36)=1.188721753874551 zeta(37)=-7.351076416083485e-25 Stats: nr=29 min=1 max=120 Emax=14.36921202632076 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 1.566324364131806e-08) ***** [1] xi(37)=1.861923863088457e-08 xi_scaled(37)=1.188721765252307 zeta(38)=-2.45035905824832e-25 Stats: nr=25 min=2 max=94 Safeguard: keep additional 25 states Emax=16.16375705163269 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=0.4999999999996891 neg=0.4999999999996825 sum= 0.9999999999993716 mu1=1.576516694967722e-14 mu2=1.28203095043484 mu3=1.015187933717243e-12 mu4=9.061631024832831 f=0.4999999999996892 b=0.4999999999996891 Spectrum: self_d-A_d FDM [self_d-A_d] pos=0.3604576141800254 neg=-0.3604576141800346 sum= -9.214851104388799e-15 mu1=1.00536365121287 mu2=3.896882816434299e-14 mu3=2.606447630267815 mu4=1.742606059451646e-12 f=0.3604576141800261 b=0.3604576141800245 Memory usage report =================== after diag: 22852 kB after recalc: 23444 kB after split: 22852 kB after trim: 23444 kB after trunc: 22852 kB diag_h: 10904 kB Peak usage: 23444 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: 1 s