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 strategy=kept lastall=1 lastalloverride=0 z=0.5 discretization=Z band=manual_V 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 n_d SZd specs= specd=A_d-A_d-u self_d-A_d-u A_d-A_d-d self_d-A_d-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=manual preccpp=2000 checksumrules=0 globalB=0 globalBx=0 polarized=1 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: QSZ invdim=2 0 Q additive 1 SSZ additive I=(0 0) [0 (additive), 0 (additive)] singlet QNs=(0 0) mult=1 >> Using sneg version 1.250 V8 >> Number of channels, impurities, chain sites, subspaces: channels=1 impurities=1 Nmax=30 subspaces=9 Reading <||||> (e) Reading <||n_d||> (s) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||SZd||> (s) Reading <||||> (z) length_coef_table=30 Nmax=30 Number of invariant subspaces: 9 (-2 1) 1 states 0.1839531284297556 (-1 0) 2 states 0.06187148471230947 0.3124538162940916 (-1 2) 2 states 0.1177167264510764 0.1853651193836887 (0 -1) 1 states 0.1903721725766456 (0 1) 4 states 0 0.07786130269992825 0.2499899418501722 0.3258078944412069 (0 3) 1 states 0.1191287174050095 (1 0) 2 states 0.1309364811720146 0.2196408119845278 (1 2) 2 states 0.01602890083972634 0.2633049371451801 (2 1) 1 states 0.1602051205798968 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) =-4.256910690682434e-06 =1.000006570185673 ***** [NRG] Iteration 1/30 (scale 1.0201394465967895) ***** [1] xi(0)=0.5906288637704714 xi_scaled(0)=0.5789687534785798 zeta(1)=0.008402131168794466 [2] xi(0)=0.5936055281210215 xi_scaled(0)=0.581886652948579 zeta(1)=-0.004503279430684824 Stats: nr=16 min=1 max=9 Emax=2.402106578531025 nrkept=64 nrkeptmult=64 Total energy=-1.237766731750827 Egs=-0.9699742868371836 Kept: 64 out of 64, ratio=1 =-1.132586446826997e-05 =1.000017343519902 Memory used: 48 MB Time elapsed: 0 s ***** [NRG] Iteration 2/30 (scale 0.72134752044448169) ***** [1] xi(1)=0.5603706212290712 xi_scaled(1)=0.7768386323471115 zeta(2)=0.008437907849412051 [2] xi(1)=0.5599810589685636 xi_scaled(1)=0.7762985843820648 zeta(2)=-0.004135764930807297 Stats: nr=25 min=1 max=36 Emax=4.983117953816574 nrkept=256 nrkeptmult=256 Total energy=-1.810094043938746 Egs=-0.7934141256010157 Kept: 256 out of 256, ratio=1 =-3.034514411205257e-05 =1.000045940500804 Memory used: 57 MB Time elapsed: 0 s ***** [NRG] Iteration 3/30 (scale 0.51006972329839473) ***** [1] xi(2)=0.5068303722097022 xi_scaled(2)=0.9936491994315109 zeta(3)=0.01900499416035763 [2] xi(2)=0.5066206581149796 xi_scaled(2)=0.9932380515332069 zeta(3)=-0.00941650091783681 Stats: nr=36 min=1 max=100 Emax=8.047815285992778 nrkept=965 nrkeptmult=965 Total energy=-2.530540073772849 Egs=-1.412446175348927 Kept: 965 out of 1024, ratio=0.942 =-8.13059016223573e-05 =1.000114607666506 Memory used: 72 MB Time elapsed: 0 s ***** [NRG] Iteration 4/30 (scale 0.36067376022224085) ***** [1] xi(3)=0.376870603215115 xi_scaled(3)=1.044907184217931 zeta(4)=0.0137582405812789 [2] xi(3)=0.3764424593108795 xi_scaled(3)=1.043720117257552 zeta(4)=-0.006815993551923956 Stats: nr=49 min=1 max=369 Emax=8.0002721528523 nrkept=1962 nrkeptmult=1962 Total energy=-2.915932107055532 Egs=-1.068533605120625 Kept: 1962 out of 3860, ratio=0.508 =-0.0001767132759649383 =1.000284176000419 Memory used: 84 MB Time elapsed: 0 s ***** [NRG] Iteration 5/30 (scale 0.25503486164919736) ***** [1] xi(4)=0.2588353378628234 xi_scaled(4)=1.014901791029862 zeta(5)=0.006921834305644262 [2] xi(4)=0.2585926697417124 xi_scaled(4)=1.013950281422345 zeta(5)=-0.003436955818071762 Stats: nr=61 min=1 max=595 Emax=8.000213959401227 nrkept=2256 nrkeptmult=2256 Total energy=-3.256029067164347 Egs=-1.333531258862253 Kept: 2256 out of 7848, ratio=0.287 =-0.0003995795173857395 =1.000580535571008 Memory used: 108 MB Time elapsed: 1 s ***** [NRG] Iteration 6/30 (scale 0.18033688011112042) ***** [1] xi(5)=0.1804448161204908 xi_scaled(5)=1.000598524324608 zeta(6)=0.003496455059703074 [2] xi(5)=0.1803507754018745 xi_scaled(5)=1.000077051852874 zeta(6)=-0.001740358948560854 Stats: nr=69 min=1 max=757 Emax=8.002357819312987 nrkept=2116 nrkeptmult=2116 Total energy=-3.449059297984778 Egs=-1.07038688204814 Kept: 2116 out of 9024, ratio=0.234 =-0.0007989972580963153 =1.001057540069013 Memory used: 109 MB Time elapsed: 2 s ***** [NRG] Iteration 7/30 (scale 0.12751743082459868) ***** [1] xi(6)=0.1273592030290158 xi_scaled(6)=0.9987591673188546 zeta(7)=0.001812094999356208 [2] xi(6)=0.127323565927368 xi_scaled(6)=0.9984796988460556 zeta(7)=-0.00090331356948184 Stats: nr=60 min=2 max=643 Emax=8.000891599953469 nrkept=1877 nrkeptmult=1877 Total energy=-3.610593651874756 Egs=-1.266762926804645 Kept: 1877 out of 8464, ratio=0.222 =-0.001439106002903591 =1.001775981946387 Memory used: 109 MB Time elapsed: 3 s ***** [NRG] Iteration 8/30 (scale 0.090168440055560212) ***** [1] xi(7)=0.0900893461150683 xi_scaled(7)=0.9991228201303786 zeta(8)=0.000941297187775152 [2] xi(7)=0.09007575457180768 xi_scaled(7)=0.9989720850921295 zeta(8)=-0.0004696214979019654 Stats: nr=69 min=1 max=644 Emax=8.00136596444993 nrkept=1867 nrkeptmult=1867 Total energy=-3.711710634723513 Egs=-1.121423225093516 Kept: 1867 out of 7508, ratio=0.249 =-0.002400857153527155 =1.002690170774314 Memory used: 113 MB Time elapsed: 4 s ***** [NRG] Iteration 9/30 (scale 0.063758715412299341) ***** [1] xi(8)=0.06372782089558825 xi_scaled(8)=0.9995154463744867 zeta(9)=0.0004878476198271267 [2] xi(8)=0.06372266427158922 xi_scaled(8)=0.9994345692118012 zeta(9)=-0.0002435081439513512 Stats: nr=60 min=2 max=566 Emax=8.000753005051127 nrkept=1683 nrkeptmult=1683 Total energy=-3.788978361451896 Egs=-1.211877093644794 Kept: 1683 out of 7468, ratio=0.225 =-0.003757045294631527 =1.003665586415146 Memory used: 113 MB Time elapsed: 5 s ***** [NRG] Iteration 10/30 (scale 0.045084220027780106) ***** [1] xi(9)=0.04507291688462538 xi_scaled(9)=0.9997492882621067 zeta(10)=0.0002522891971808624 [2] xi(9)=0.04507097194660087 xi_scaled(9)=0.999706148156249 zeta(10)=-0.0001259641644970673 Stats: nr=67 min=1 max=582 Emax=8.000738580170871 nrkept=1594 nrkeptmult=1594 Total energy=-3.841815628885028 Egs=-1.171968094392538 Kept: 1594 out of 6732, ratio=0.237 =-0.005582196845969011 =1.00430704816053 Memory used: 113 MB Time elapsed: 5 s ***** [NRG] Iteration 11/30 (scale 0.031879357706149671) ***** [1] xi(10)=0.03187532634296534 xi_scaled(10)=0.9998735431490969 zeta(11)=0.0001302548283519374 [2] xi(10)=0.03187459620249342 xi_scaled(10)=0.9998506399125059 zeta(11)=-6.504455957542832e-05 Stats: nr=60 min=1 max=496 Emax=8.007426795752455 nrkept=1466 nrkeptmult=1466 Total energy=-3.878718141986806 Egs=-1.157567647439131 Kept: 1466 out of 6376, ratio=0.23 =-0.007924182490061849 =1.004470534315409 Memory used: 113 MB Time elapsed: 6 s ***** [NRG] Iteration 12/30 (scale 0.022542110013890053) ***** [1] xi(11)=0.02254068862044692 xi_scaled(11)=0.9999369449691151 zeta(12)=6.716595665640328e-05 [2] xi(11)=0.02254041545712748 xi_scaled(11)=0.9999248270564941 zeta(12)=-3.35435280105263e-05 Stats: nr=62 min=1 max=518 Emax=8.005421900040425 nrkept=1366 nrkeptmult=1366 Total energy=-3.906249836181894 Egs=-1.221345037271308 Kept: 1366 out of 5864, ratio=0.233 =-0.01093371389773702 =1.003610343313875 Memory used: 113 MB Time elapsed: 6 s ***** [NRG] Iteration 13/30 (scale 0.015939678853074835) ***** [1] xi(12)=0.01593918073730922 xi_scaled(12)=0.9999687499497193 zeta(13)=3.459605211559095e-05 [2] xi(12)=0.0159390788569602 xi_scaled(12)=0.9999623583310453 zeta(13)=-1.727883690312869e-05 Stats: nr=60 min=1 max=426 Emax=8.003729318204275 nrkept=1290 nrkeptmult=1290 Total energy=-3.923862719715795 Egs=-1.10497104090045 Kept: 1290 out of 5464, ratio=0.236 =-0.0146262842298023 =1.00154896276369 Memory used: 113 MB Time elapsed: 7 s ***** [NRG] Iteration 14/30 (scale 0.011271055006945026) ***** [1] xi(13)=0.01127088073911419 xi_scaled(13)=0.9999845384632827 zeta(14)=1.780319686693298e-05 [2] xi(13)=0.01127084286022318 xi_scaled(13)=0.9999811777405299 zeta(14)=-8.892148818627174e-06 Stats: nr=61 min=1 max=465 Emax=8.000538950427771 nrkept=1159 nrkeptmult=1159 Total energy=-3.938174745500359 Egs=-1.269803561045948 Kept: 1159 out of 5160, ratio=0.225 =-0.01925377704277203 =0.9979976419297255 Memory used: 113 MB Time elapsed: 7 s ***** [NRG] Iteration 15/30 (scale 0.0079698394265374176) ***** [1] xi(14)=0.007969778756501575 xi_scaled(14)=0.9999923875460225 zeta(15)=9.154563720140379e-06 [2] xi(14)=0.007969764698750258 xi_scaled(14)=0.9999906236771959 zeta(15)=-4.572595932323176e-06 Stats: nr=58 min=1 max=368 Emax=8.007816205191142 nrkept=1113 nrkeptmult=1113 Total energy=-3.946594883174288 Egs=-1.056500291071391 Kept: 1113 out of 4636, ratio=0.24 =-0.02495416392678261 =0.9928621931823024 Memory used: 113 MB Time elapsed: 7 s ***** [NRG] Iteration 16/30 (scale 0.0056355275034725132) ***** [1] xi(15)=0.005635506221643946 xi_scaled(15)=0.999996223631496 zeta(16)=4.703627130888212e-06 [2] xi(15)=0.005635501010682034 xi_scaled(15)=0.9999952989688254 zeta(16)=-2.349480991093797e-06 Stats: nr=56 min=1 max=405 Emax=8.004950439533626 nrkept=1002 nrkeptmult=1002 Total energy=-3.954005945985404 Egs=-1.315061066874208 Kept: 1002 out of 4452, ratio=0.225 =-0.03192912960327911 =0.9861040024836898 Memory used: 113 MB Time elapsed: 8 s ***** [NRG] Iteration 17/30 (scale 0.0039849197132687088) ***** [1] xi(16)=0.003984912437409699 xi_scaled(16)=0.9999981741516685 zeta(17)=2.414882978434889e-06 [2] xi(16)=0.00398491050932224 xi_scaled(16)=0.9999976903056697 zeta(17)=-1.206277975858803e-06 Stats: nr=58 min=1 max=332 Emax=8.003090938964393 nrkept=995 nrkeptmult=995 Total energy=-3.958053825792408 Egs=-1.015799589017009 Kept: 995 out of 4008, ratio=0.248 =-0.04018626917236539 =0.977805721404934 Memory used: 113 MB Time elapsed: 8 s ***** [NRG] Iteration 18/30 (scale 0.0028177637517362566) ***** [1] xi(17)=0.002817761056980297 xi_scaled(17)=0.9999990436544022 zeta(18)=1.238996471335688e-06 [2] xi(17)=0.002817760344788184 xi_scaled(17)=0.9999987909035771 zeta(18)=-6.18917217721972e-07 Stats: nr=55 min=1 max=364 Emax=8.000903013443812 nrkept=873 nrkeptmult=873 Total energy=-3.961866623439417 Egs=-1.353128928803779 Kept: 873 out of 3980, ratio=0.219 =-0.04970510561124566 =0.9680555108045726 Memory used: 113 MB Time elapsed: 8 s ***** [NRG] Iteration 19/30 (scale 0.0019924598566343544) ***** [1] xi(18)=0.001992459052045069 xi_scaled(18)=0.999999596182938 zeta(19)=6.35255784173615e-07 [2] xi(18)=0.001992458789413763 xi_scaled(18)=0.9999994643703418 zeta(19)=-3.173375789429131e-07 Stats: nr=56 min=1 max=293 Emax=8.003674641310971 nrkept=893 nrkeptmult=893 Total energy=-3.963830459506216 Egs=-0.9856339440215881 Kept: 893 out of 3492, ratio=0.256 =-0.05978402618059174 =0.9576116091081532 Memory used: 113 MB Time elapsed: 8 s ***** [NRG] Iteration 20/30 (scale 0.0014088818758681283) ***** [1] xi(19)=0.001408881448498392 xi_scaled(19)=0.999999696660349 zeta(20)=3.25502125505368e-07 [2] xi(19)=0.001408881351830228 xi_scaled(19)=0.9999996280469573 zeta(20)=-1.62605958216452e-07 Stats: nr=55 min=1 max=333 Emax=8.001196650349048 nrkept=761 nrkeptmult=761 Total energy=-3.965776297819174 Egs=-1.381122396623231 Kept: 761 out of 3572, ratio=0.213 =-0.06993748301359415 =0.9470310914972595 Memory used: 113 MB Time elapsed: 8 s ***** [NRG] Iteration 21/30 (scale 0.0009962299283171772) ***** [1] xi(20)=0.000996229912500716 xi_scaled(20)=0.999999984123684 zeta(21)=1.666986257209424e-07 [2] xi(20)=0.0009962298769563968 xi_scaled(20)=0.999999948444853 zeta(21)=-8.327677421003475e-08 Stats: nr=54 min=1 max=261 Emax=8.006231805341098 nrkept=771 nrkeptmult=771 Total energy=-3.966738626763599 Egs=-0.9659707232957586 Kept: 771 out of 3044, ratio=0.253 =-0.07896449377534341 =0.9375789768024019 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 22/30 (scale 0.00070444093793406415) ***** [1] xi(21)=0.0007044407747059971 xi_scaled(21)=0.9999997682870795 zeta(22)=8.53221697754037e-08 [2] xi(21)=0.0007044407616446054 xi_scaled(21)=0.9999997497455795 zeta(22)=-4.262481923608869e-08 Stats: nr=51 min=1 max=290 Emax=8.001795979771751 nrkept=672 nrkeptmult=672 Total energy=-3.967724267267477 Egs=-1.39918118155961 Kept: 672 out of 3084, ratio=0.218 =-0.08630554260336053 =0.9298681544738898 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 23/30 (scale 0.0004981149641585886) ***** [1] xi(22)=0.0004981150392048794 xi_scaled(22)=1.000000150660583 zeta(23)=4.364627726673246e-08 [2] xi(22)=0.0004981150344108429 xi_scaled(22)=1.000000141036225 zeta(23)=-2.180500671683421e-08 Stats: nr=53 min=1 max=234 Emax=8.00388228070122 nrkept=680 nrkeptmult=680 Total energy=-3.968199689708842 Egs=-0.9544432020192182 Kept: 680 out of 2688, ratio=0.253 =-0.09157138769594071 =0.9243361855718224 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 24/30 (scale 0.00035222046896703208) ***** [1] xi(23)=0.0003522203411331119 xi_scaled(23)=0.9999996370627734 zeta(24)=2.23160127385798e-08 [2] xi(23)=0.0003522203393754953 xi_scaled(23)=0.9999996320726698 zeta(24)=-1.11489406958893e-08 Stats: nr=49 min=1 max=263 Emax=8.002975930746318 nrkept=609 nrkeptmult=609 Total energy=-3.968696211483853 Egs=-1.409690289912741 Kept: 609 out of 2720, ratio=0.224 =-0.09496711714039772 =0.9207556066405141 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 25/30 (scale 0.0002490574820792943) ***** [1] xi(24)=0.0002490575695087961 xi_scaled(24)=1.000000351041459 zeta(25)=1.140429345899723e-08 [2] xi(24)=0.0002490575688651372 xi_scaled(24)=1.00000034845708 zeta(25)=-5.697613930989671e-09 Stats: nr=53 min=1 max=213 Emax=8.00057306304805 nrkept=607 nrkeptmult=607 Total energy=-3.968932357149705 Egs=-0.9481572843343929 Kept: 607 out of 2436, ratio=0.249 =-0.09700233715077546 =0.9186120120804798 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 26/30 (scale 0.00017611023448351604) ***** [1] xi(25)=0.0001761101096519996 xi_scaled(25)=0.999999291173981 zeta(26)=5.825138428948929e-09 [2] xi(25)=0.0001761101094165965 xi_scaled(25)=0.9999992898373004 zeta(26)=-2.910302846098721e-09 Stats: nr=46 min=1 max=229 Emax=8.001116472465982 nrkept=565 nrkeptmult=565 Total energy=-3.969181623940266 Egs=-1.415402070712658 Kept: 565 out of 2428, ratio=0.233 =-0.09807938443083311 =0.917475964947124 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 27/30 (scale 0.00012452874103964715) ***** [1] xi(26)=0.0001245288292390404 xi_scaled(26)=1.000000708265357 zeta(27)=2.974268574968405e-09 [2] xi(26)=0.0001245288291530076 xi_scaled(26)=1.00000070757449 zeta(27)=-1.486001099066876e-09 Stats: nr=52 min=1 max=202 Emax=8.001823531192892 nrkept=579 nrkeptmult=579 Total energy=-3.969299287682564 Egs=-0.9448721742122642 Kept: 579 out of 2260, ratio=0.256 =-0.09866156545015847 =0.9168622085240695 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 28/30 (scale 8.8055117241758019e-05) ***** [1] xi(27)=8.805499265586587e-05 xi_scaled(27)=0.9999985851373997 zeta(28)=1.517940550123208e-09 [2] xi(27)=8.80549926244336e-05 xi_scaled(27)=0.9999985847804383 zeta(28)=-7.584036907965321e-10 Stats: nr=46 min=1 max=214 Emax=8.003239734428098 nrkept=548 nrkeptmult=548 Total energy=-3.969424183674231 Egs=-1.418384252720579 Kept: 548 out of 2316, ratio=0.237 =-0.09895246264036056 =0.9165553038362806 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 29/30 (scale 6.2264370519823575e-05) ***** [1] xi(28)=6.226445874858231e-05 xi_scaled(28)=1.00000141700234 zeta(29)=7.743770085023972e-10 [2] xi(28)=6.226445873710828e-05 xi_scaled(28)=1.000001416818061 zeta(29)=-3.869052067498631e-10 Stats: nr=52 min=1 max=198 Emax=8.004593449042254 nrkept=571 nrkeptmult=571 Total energy=-3.969482911082773 Egs=-0.9431944473356381 Kept: 571 out of 2192, ratio=0.26 =-0.09910473902760149 =0.9163947081219208 Memory used: 113 MB Time elapsed: 9 s ***** [NRG] Iteration 30/30 (scale 4.402755862087901e-05) ***** [1] xi(29)=4.402743418778709e-05 xi_scaled(29)=0.9999971737453582 zeta(30)=3.948788978454525e-10 [2] xi(29)=4.402743418360215e-05 xi_scaled(29)=0.9999971736503056 zeta(30)=-1.97297804236053e-10 Stats: nr=46 min=1 max=211 Emax=8.006718383211306 nrkept=2284 nrkeptmult=2284 Total energy=-3.969545426078692 Egs=-1.419906028809846 Kept: 2284 out of 2284, ratio=1 =-0.09917632480668184 =0.9163192678559154 Memory used: 113 MB Time elapsed: 10 s ** Iteration completed. Total energy: -3.969545426078692 TKW=0.004137744028945878 Grand canonical Z= 1 Zft (last shell)= 1 Calculating density matrices. [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] 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: QSZ >> Using sneg version 1.250 V8 >> Number of channels, impurities, chain sites, subspaces: channels=1 impurities=1 Nmax=30 subspaces=9 Reading <||||> (e) Reading <||n_d||> (s) Reading <||A_d||> (d) Reading <||self_d||> (d) Reading <||SZd||> (s) Reading <||||> (z) Number of invariant subspaces: 9 (-2 1) 1 states 0.1839531284297556 (-1 0) 2 states 0.06187148471230947 0.3124538162940916 (-1 2) 2 states 0.1177167264510764 0.1853651193836887 (0 -1) 1 states 0.1903721725766456 (0 1) 4 states 0 0.07786130269992825 0.2499899418501722 0.3258078944412069 (0 3) 1 states 0.1191287174050095 (1 0) 2 states 0.1309364811720146 0.2196408119845278 (1 2) 2 states 0.01602890083972634 0.2633049371451801 (2 1) 1 states 0.1602051205798968 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-d FDM Spectrum: self_d-A_d-d FDM Spectrum: A_d-A_d-u FDM Spectrum: self_d-A_d-u FDM ***** [DM] Iteration 1/30 (scale 1.0201394465967895) ***** [1] xi(0)=0.5906288637704714 xi_scaled(0)=0.5789687534785798 zeta(1)=0.008402131168794466 [2] xi(0)=0.5936055281210215 xi_scaled(0)=0.581886652948579 zeta(1)=-0.004503279430684824 Stats: nr=16 min=1 max=9 Emax=2.402106578531025 nrkept=64 nrkeptmult=64 Kept: 64 out of 64, ratio=1 Memory used: 124 MB Time elapsed: 13 s ***** [DM] Iteration 2/30 (scale 0.72134752044448169) ***** [1] xi(1)=0.5603706212290712 xi_scaled(1)=0.7768386323471115 zeta(2)=0.008437907849412051 [2] xi(1)=0.5599810589685636 xi_scaled(1)=0.7762985843820648 zeta(2)=-0.004135764930807297 Stats: nr=25 min=1 max=36 Emax=4.983117953816574 nrkept=256 nrkeptmult=256 Kept: 256 out of 256, ratio=1 Memory used: 124 MB Time elapsed: 13 s ***** [DM] Iteration 3/30 (scale 0.51006972329839473) ***** [1] xi(2)=0.5068303722097022 xi_scaled(2)=0.9936491994315109 zeta(3)=0.01900499416035763 [2] xi(2)=0.5066206581149796 xi_scaled(2)=0.9932380515332069 zeta(3)=-0.00941650091783681 Stats: nr=36 min=1 max=100 Emax=8.047815285992778 nrkept=965 nrkeptmult=965 Kept: 965 out of 1024, ratio=0.942 Memory used: 124 MB Time elapsed: 13 s ***** [DM] Iteration 4/30 (scale 0.36067376022224085) ***** [1] xi(3)=0.376870603215115 xi_scaled(3)=1.044907184217931 zeta(4)=0.0137582405812789 [2] xi(3)=0.3764424593108795 xi_scaled(3)=1.043720117257552 zeta(4)=-0.006815993551923956 Stats: nr=49 min=1 max=369 Emax=8.0002721528523 nrkept=1962 nrkeptmult=1962 Kept: 1962 out of 3860, ratio=0.508 Memory used: 124 MB Time elapsed: 13 s ***** [DM] Iteration 5/30 (scale 0.25503486164919736) ***** [1] xi(4)=0.2588353378628234 xi_scaled(4)=1.014901791029862 zeta(5)=0.006921834305644262 [2] xi(4)=0.2585926697417124 xi_scaled(4)=1.013950281422345 zeta(5)=-0.003436955818071762 Stats: nr=61 min=1 max=595 Emax=8.000213959401227 nrkept=2256 nrkeptmult=2256 Kept: 2256 out of 7848, ratio=0.287 Memory used: 182 MB Time elapsed: 15 s ***** [DM] Iteration 6/30 (scale 0.18033688011112042) ***** [1] xi(5)=0.1804448161204908 xi_scaled(5)=1.000598524324608 zeta(6)=0.003496455059703074 [2] xi(5)=0.1803507754018745 xi_scaled(5)=1.000077051852874 zeta(6)=-0.001740358948560854 Stats: nr=69 min=1 max=757 Emax=8.002357819312987 nrkept=2116 nrkeptmult=2116 Kept: 2116 out of 9024, ratio=0.234 Memory used: 205 MB Time elapsed: 16 s ***** [DM] Iteration 7/30 (scale 0.12751743082459868) ***** [1] xi(6)=0.1273592030290158 xi_scaled(6)=0.9987591673188546 zeta(7)=0.001812094999356208 [2] xi(6)=0.127323565927368 xi_scaled(6)=0.9984796988460556 zeta(7)=-0.00090331356948184 Stats: nr=60 min=2 max=643 Emax=8.000891599953469 nrkept=1877 nrkeptmult=1877 Kept: 1877 out of 8464, ratio=0.222 Memory used: 192 MB Time elapsed: 18 s ***** [DM] Iteration 8/30 (scale 0.090168440055560212) ***** [1] xi(7)=0.0900893461150683 xi_scaled(7)=0.9991228201303786 zeta(8)=0.000941297187775152 [2] xi(7)=0.09007575457180768 xi_scaled(7)=0.9989720850921295 zeta(8)=-0.0004696214979019654 Stats: nr=69 min=1 max=644 Emax=8.00136596444993 nrkept=1867 nrkeptmult=1867 Kept: 1867 out of 7508, ratio=0.249 Memory used: 192 MB Time elapsed: 19 s ***** [DM] Iteration 9/30 (scale 0.063758715412299341) ***** [1] xi(8)=0.06372782089558825 xi_scaled(8)=0.9995154463744867 zeta(9)=0.0004878476198271267 [2] xi(8)=0.06372266427158922 xi_scaled(8)=0.9994345692118012 zeta(9)=-0.0002435081439513512 Stats: nr=60 min=2 max=566 Emax=8.000753005051127 nrkept=1683 nrkeptmult=1683 Kept: 1683 out of 7468, ratio=0.225 Memory used: 192 MB Time elapsed: 20 s ***** [DM] Iteration 10/30 (scale 0.045084220027780106) ***** [1] xi(9)=0.04507291688462538 xi_scaled(9)=0.9997492882621067 zeta(10)=0.0002522891971808624 [2] xi(9)=0.04507097194660087 xi_scaled(9)=0.999706148156249 zeta(10)=-0.0001259641644970673 Stats: nr=67 min=1 max=582 Emax=8.000738580170871 nrkept=1594 nrkeptmult=1594 Kept: 1594 out of 6732, ratio=0.237 Memory used: 192 MB Time elapsed: 21 s ***** [DM] Iteration 11/30 (scale 0.031879357706149671) ***** [1] xi(10)=0.03187532634296534 xi_scaled(10)=0.9998735431490969 zeta(11)=0.0001302548283519374 [2] xi(10)=0.03187459620249342 xi_scaled(10)=0.9998506399125059 zeta(11)=-6.504455957542832e-05 Stats: nr=60 min=1 max=496 Emax=8.007426795752455 nrkept=1466 nrkeptmult=1466 Kept: 1466 out of 6376, ratio=0.23 Memory used: 192 MB Time elapsed: 22 s ***** [DM] Iteration 12/30 (scale 0.022542110013890053) ***** [1] xi(11)=0.02254068862044692 xi_scaled(11)=0.9999369449691151 zeta(12)=6.716595665640328e-05 [2] xi(11)=0.02254041545712748 xi_scaled(11)=0.9999248270564941 zeta(12)=-3.35435280105263e-05 Stats: nr=62 min=1 max=518 Emax=8.005421900040425 nrkept=1366 nrkeptmult=1366 Kept: 1366 out of 5864, ratio=0.233 Memory used: 192 MB Time elapsed: 22 s ***** [DM] Iteration 13/30 (scale 0.015939678853074835) ***** [1] xi(12)=0.01593918073730922 xi_scaled(12)=0.9999687499497193 zeta(13)=3.459605211559095e-05 [2] xi(12)=0.0159390788569602 xi_scaled(12)=0.9999623583310453 zeta(13)=-1.727883690312869e-05 Stats: nr=60 min=1 max=426 Emax=8.003729318204275 nrkept=1290 nrkeptmult=1290 Kept: 1290 out of 5464, ratio=0.236 Memory used: 192 MB Time elapsed: 23 s ***** [DM] Iteration 14/30 (scale 0.011271055006945026) ***** [1] xi(13)=0.01127088073911419 xi_scaled(13)=0.9999845384632827 zeta(14)=1.780319686693298e-05 [2] xi(13)=0.01127084286022318 xi_scaled(13)=0.9999811777405299 zeta(14)=-8.892148818627174e-06 Stats: nr=61 min=1 max=465 Emax=8.000538950427771 nrkept=1159 nrkeptmult=1159 Kept: 1159 out of 5160, ratio=0.225 Memory used: 192 MB Time elapsed: 24 s ***** [DM] Iteration 15/30 (scale 0.0079698394265374176) ***** [1] xi(14)=0.007969778756501575 xi_scaled(14)=0.9999923875460225 zeta(15)=9.154563720140379e-06 [2] xi(14)=0.007969764698750258 xi_scaled(14)=0.9999906236771959 zeta(15)=-4.572595932323176e-06 Stats: nr=58 min=1 max=368 Emax=8.007816205191142 nrkept=1113 nrkeptmult=1113 Kept: 1113 out of 4636, ratio=0.24 Memory used: 192 MB Time elapsed: 24 s ***** [DM] Iteration 16/30 (scale 0.0056355275034725132) ***** [1] xi(15)=0.005635506221643946 xi_scaled(15)=0.999996223631496 zeta(16)=4.703627130888212e-06 [2] xi(15)=0.005635501010682034 xi_scaled(15)=0.9999952989688254 zeta(16)=-2.349480991093797e-06 Stats: nr=56 min=1 max=405 Emax=8.004950439533626 nrkept=1002 nrkeptmult=1002 Kept: 1002 out of 4452, ratio=0.225 Memory used: 192 MB Time elapsed: 24 s ***** [DM] Iteration 17/30 (scale 0.0039849197132687088) ***** [1] xi(16)=0.003984912437409699 xi_scaled(16)=0.9999981741516685 zeta(17)=2.414882978434889e-06 [2] xi(16)=0.00398491050932224 xi_scaled(16)=0.9999976903056697 zeta(17)=-1.206277975858803e-06 Stats: nr=58 min=1 max=332 Emax=8.003090938964393 nrkept=995 nrkeptmult=995 Kept: 995 out of 4008, ratio=0.248 Memory used: 192 MB Time elapsed: 25 s ***** [DM] Iteration 18/30 (scale 0.0028177637517362566) ***** [1] xi(17)=0.002817761056980297 xi_scaled(17)=0.9999990436544022 zeta(18)=1.238996471335688e-06 [2] xi(17)=0.002817760344788184 xi_scaled(17)=0.9999987909035771 zeta(18)=-6.18917217721972e-07 Stats: nr=55 min=1 max=364 Emax=8.000903013443812 nrkept=873 nrkeptmult=873 Kept: 873 out of 3980, ratio=0.219 Memory used: 192 MB Time elapsed: 25 s ***** [DM] Iteration 19/30 (scale 0.0019924598566343544) ***** [1] xi(18)=0.001992459052045069 xi_scaled(18)=0.999999596182938 zeta(19)=6.35255784173615e-07 [2] xi(18)=0.001992458789413763 xi_scaled(18)=0.9999994643703418 zeta(19)=-3.173375789429131e-07 Stats: nr=56 min=1 max=293 Emax=8.003674641310971 nrkept=893 nrkeptmult=893 Kept: 893 out of 3492, ratio=0.256 Memory used: 192 MB Time elapsed: 25 s ***** [DM] Iteration 20/30 (scale 0.0014088818758681283) ***** [1] xi(19)=0.001408881448498392 xi_scaled(19)=0.999999696660349 zeta(20)=3.25502125505368e-07 [2] xi(19)=0.001408881351830228 xi_scaled(19)=0.9999996280469573 zeta(20)=-1.62605958216452e-07 Stats: nr=55 min=1 max=333 Emax=8.001196650349048 nrkept=761 nrkeptmult=761 Kept: 761 out of 3572, ratio=0.213 Memory used: 192 MB Time elapsed: 26 s ***** [DM] Iteration 21/30 (scale 0.0009962299283171772) ***** [1] xi(20)=0.000996229912500716 xi_scaled(20)=0.999999984123684 zeta(21)=1.666986257209424e-07 [2] xi(20)=0.0009962298769563968 xi_scaled(20)=0.999999948444853 zeta(21)=-8.327677421003475e-08 Stats: nr=54 min=1 max=261 Emax=8.006231805341098 nrkept=771 nrkeptmult=771 Kept: 771 out of 3044, ratio=0.253 Memory used: 192 MB Time elapsed: 26 s ***** [DM] Iteration 22/30 (scale 0.00070444093793406415) ***** [1] xi(21)=0.0007044407747059971 xi_scaled(21)=0.9999997682870795 zeta(22)=8.53221697754037e-08 [2] xi(21)=0.0007044407616446054 xi_scaled(21)=0.9999997497455795 zeta(22)=-4.262481923608869e-08 Stats: nr=51 min=1 max=290 Emax=8.001795979771751 nrkept=672 nrkeptmult=672 Kept: 672 out of 3084, ratio=0.218 Memory used: 192 MB Time elapsed: 26 s ***** [DM] Iteration 23/30 (scale 0.0004981149641585886) ***** [1] xi(22)=0.0004981150392048794 xi_scaled(22)=1.000000150660583 zeta(23)=4.364627726673246e-08 [2] xi(22)=0.0004981150344108429 xi_scaled(22)=1.000000141036225 zeta(23)=-2.180500671683421e-08 Stats: nr=53 min=1 max=234 Emax=8.00388228070122 nrkept=680 nrkeptmult=680 Kept: 680 out of 2688, ratio=0.253 Memory used: 192 MB Time elapsed: 26 s ***** [DM] Iteration 24/30 (scale 0.00035222046896703208) ***** [1] xi(23)=0.0003522203411331119 xi_scaled(23)=0.9999996370627734 zeta(24)=2.23160127385798e-08 [2] xi(23)=0.0003522203393754953 xi_scaled(23)=0.9999996320726698 zeta(24)=-1.11489406958893e-08 Stats: nr=49 min=1 max=263 Emax=8.002975930746318 nrkept=609 nrkeptmult=609 Kept: 609 out of 2720, ratio=0.224 Memory used: 192 MB Time elapsed: 27 s ***** [DM] Iteration 25/30 (scale 0.0002490574820792943) ***** [1] xi(24)=0.0002490575695087961 xi_scaled(24)=1.000000351041459 zeta(25)=1.140429345899723e-08 [2] xi(24)=0.0002490575688651372 xi_scaled(24)=1.00000034845708 zeta(25)=-5.697613930989671e-09 Stats: nr=53 min=1 max=213 Emax=8.00057306304805 nrkept=607 nrkeptmult=607 Kept: 607 out of 2436, ratio=0.249 Memory used: 192 MB Time elapsed: 27 s ***** [DM] Iteration 26/30 (scale 0.00017611023448351604) ***** [1] xi(25)=0.0001761101096519996 xi_scaled(25)=0.999999291173981 zeta(26)=5.825138428948929e-09 [2] xi(25)=0.0001761101094165965 xi_scaled(25)=0.9999992898373004 zeta(26)=-2.910302846098721e-09 Stats: nr=46 min=1 max=229 Emax=8.001116472465982 nrkept=565 nrkeptmult=565 Kept: 565 out of 2428, ratio=0.233 Memory used: 192 MB Time elapsed: 27 s ***** [DM] Iteration 27/30 (scale 0.00012452874103964715) ***** [1] xi(26)=0.0001245288292390404 xi_scaled(26)=1.000000708265357 zeta(27)=2.974268574968405e-09 [2] xi(26)=0.0001245288291530076 xi_scaled(26)=1.00000070757449 zeta(27)=-1.486001099066876e-09 Stats: nr=52 min=1 max=202 Emax=8.001823531192892 nrkept=579 nrkeptmult=579 Kept: 579 out of 2260, ratio=0.256 Memory used: 192 MB Time elapsed: 27 s ***** [DM] Iteration 28/30 (scale 8.8055117241758019e-05) ***** [1] xi(27)=8.805499265586587e-05 xi_scaled(27)=0.9999985851373997 zeta(28)=1.517940550123208e-09 [2] xi(27)=8.80549926244336e-05 xi_scaled(27)=0.9999985847804383 zeta(28)=-7.584036907965321e-10 Stats: nr=46 min=1 max=214 Emax=8.003239734428098 nrkept=548 nrkeptmult=548 Kept: 548 out of 2316, ratio=0.237 Memory used: 192 MB Time elapsed: 27 s ***** [DM] Iteration 29/30 (scale 6.2264370519823575e-05) ***** [1] xi(28)=6.226445874858231e-05 xi_scaled(28)=1.00000141700234 zeta(29)=7.743770085023972e-10 [2] xi(28)=6.226445873710828e-05 xi_scaled(28)=1.000001416818061 zeta(29)=-3.869052067498631e-10 Stats: nr=52 min=1 max=198 Emax=8.004593449042254 nrkept=571 nrkeptmult=571 Kept: 571 out of 2192, ratio=0.26 Memory used: 192 MB Time elapsed: 27 s ***** [DM] Iteration 30/30 (scale 4.402755862087901e-05) ***** [1] xi(29)=4.402743418778709e-05 xi_scaled(29)=0.9999971737453582 zeta(30)=3.948788978454525e-10 [2] xi(29)=4.402743418360215e-05 xi_scaled(29)=0.9999971736503056 zeta(30)=-1.97297804236053e-10 Stats: nr=46 min=1 max=211 Emax=8.006718383211306 nrkept=2284 nrkeptmult=2284 Kept: 2284 out of 2284, ratio=1 Memory used: 192 MB Time elapsed: 27 s ** Iteration completed. Spectrum: A_d-A_d-d FDM [A_d-A_d-d] pos=0.4429449369868492 neg=0.5570550630126292 sum= 0.9999999999994784 mu1=-0.007082511303364146 mu2=0.03309114514033863 mu3=0.0006943550239921839 mu4=0.01336146961159385 f=0.4429449369868492 b=0.4429449369868492 Spectrum: self_d-A_d-d FDM [self_d-A_d-d] pos=-0.0004411935891658138 neg=-0.006566531179694858 sum= -0.007007724768860672 mu1=0.0006320644051987752 mu2=-0.0002327905136065378 mu3=3.893506877788444e-05 mu4=-9.197363630979276e-05 f=-0.0004411935891658138 b=-0.0004411935891658138 Spectrum: A_d-A_d-u FDM [A_d-A_d-u] pos=0.640154495376935 neg=0.3598455046222207 sum= 0.9999999999991558 mu1=0.00288524609126016 mu2=0.00258302995798153 mu3=-9.302727591089361e-05 mu4=0.0007949141259514065 f=0.640154495376935 b=0.640154495376935 Spectrum: self_d-A_d-u FDM [self_d-A_d-u] pos=0.004489045370296947 neg=-0.001636292219714586 sum= 0.002852753150582361 mu1=0.000633169756209211 mu2=4.230345853475383e-05 mu3=5.950150204270684e-05 mu4=1.216442725838898e-05 f=0.004489045370296947 b=0.004489045370296947 Memory usage report =================== after diag: 210516 kB after recalc: 221532 kB after split: 210516 kB after trim: 210516 kB after trunc: 210516 kB diag_h: 123492 kB Peak usage: 221532 kB Timing report ============= All: 27 s DM: 1 s FDM: 2 s diag: 7 s recalc d: 4 s recalc s: 0 s spec d: 8 s Other: 3 s