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=/work/zitko/nrg/work.iafW2NuETt substeps=0 Ninit=0 Lambda=2 strategy=kept lastall=0 lastalloverride=0 z=1 discretization=Z band=flat bandrescale=1 betabar=1 T=-999 keep=10000 keepenergy=9 keepmin=0 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=100 accumulation=0 linstep=0 discard_trim=1e-16 discard_immediately=1e-16 NN1=0 NN2even=1 NN2avg=0 NNtanh=0 goodE=2 savebins=0 broaden=1 broaden_max=2.5 broaden_min=-99 broaden_min_ratio=3 broaden_ratio=1.05 dumpenergies=0 dumpannotated=0 dumpscaled=1 dumpabs=0 dumpprecision=8 dumpgroups=1 grouptol=1e-06 dumpdiagonal=0 ops=A_d specs= specd= spect= specq= specot= reim=0 specgt=A_d-A_d gtp=0.7 speci1t=A_d-A_d speci2t=A_d-A_d specchit= chitp=1 chitp_ratio=-999 dm=0 T0opt=-1 dmnrg=0 cfs=0 cfsgt=0 cfsls=0 fdm=0 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=66 subspaces=6 Reading <||||> (e) Reading <||A_d||> (d) Reading <||||> (z) length_coef_table=66 Nmax=66 Number of invariant subspaces: 6 (-2 1) 1 states 0.05197773662704051 (-1 2) 2 states 0.02467276690857563 0.07438141562816265 (0 1) 3 states 0 0.05197773662704051 0.09905418253673831 (0 3) 1 states 0.04707644590969777 (1 2) 2 states 0.02467276690857563 0.07438141562816265 (2 1) 1 states 0.05197773662704051 Number of states (multiplicity taken into account): 16 Computing the following operators: s=[] p=[] g=[] d=[A_d ] v=[] t=[] q=[] ot=[] Computing the following spectra: Spectrum: A_d-A_d GT Spectrum: A_d-A_d I1T Spectrum: A_d-A_d I2T Before NRG iteration (N=-1) GT[A_d-A_d]=0.3499786638424088 I1T[A_d-A_d]=-7.047314121155779e-19 I2T[A_d-A_d]=0.0002315446174950926 ***** [NRG] Iteration 1/66 (scale 0.72134752044448169) ***** [1] xi(0)=0.5452874708426226 xi_scaled(0)=0.7559289460184545 zeta(1)=0 Stats: nr=10 min=1 max=8 Emax=3.033853186584265 nrkept=35 nrkeptmult=64 Total energy=-1.091731236767575 Egs=-1.446884709115515 Kept: 35 out of 35, ratio=1 GT[A_d-A_d]=0.4948355170386223 I1T[A_d-A_d]=-1.535501326782596e-17 I2T[A_d-A_d]=0.000250811123831895 Memory used: 46 MB Time elapsed: 0 s ***** [NRG] Iteration 2/66 (scale 0.51006972329839473) ***** [1] xi(1)=0.4155094682917544 xi_scaled(1)=0.8146130799625568 zeta(2)=0 Stats: nr=15 min=1 max=20 Emax=5.498748496786248 nrkept=126 nrkeptmult=256 Total energy=-1.399872562121613 Egs=-0.6041160870349737 Kept: 126 out of 126, ratio=1 GT[A_d-A_d]=0.6994971040834835 I1T[A_d-A_d]=1.479597152263812e-16 I2T[A_d-A_d]=0.0003066437655251823 Memory used: 46 MB Time elapsed: 0 s ***** [NRG] Iteration 3/66 (scale 0.36067376022224085) ***** [1] xi(2)=0.3218991776760922 xi_scaled(2)=0.8924940297229927 zeta(3)=0 Stats: nr=21 min=1 max=75 Emax=9.312219962974785 nrkept=439 nrkeptmult=984 Total energy=-1.924859733508717 Egs=-1.45557351070845 Kept: 439 out of 462, ratio=0.95 GT[A_d-A_d]=0.9885911840184093 I1T[A_d-A_d]=-1.226679466960782e-16 I2T[A_d-A_d]=0.0003324881967482402 Memory used: 63 MB Time elapsed: 0 s ***** [NRG] Iteration 4/66 (scale 0.25503486164919736) ***** [1] xi(3)=0.2402694094581714 xi_scaled(3)=0.942104180991005 zeta(4)=0 Stats: nr=28 min=1 max=197 Safeguard: keep additional 5 states Emax=9.586829006840102 nrkept=1008 nrkeptmult=2416 Total energy=-2.129362555107394 Egs=-0.8018622249375925 Kept: 1008 out of 1634, ratio=0.617 GT[A_d-A_d]=1.396696245707145 I1T[A_d-A_d]=-3.054849933784399e-16 I2T[A_d-A_d]=0.0003518366011730921 Memory used: 66 MB Time elapsed: 0 s ***** [NRG] Iteration 5/66 (scale 0.18033688011112042) ***** [1] xi(4)=0.1749149187687819 xi_scaled(4)=0.9699342622596243 zeta(5)=0 Stats: nr=36 min=1 max=454 Emax=9.25088891168263 nrkept=1180 nrkeptmult=2864 Total energy=-2.397098922237594 Egs=-1.484645664077284 Kept: 1180 out of 3781, ratio=0.312 GT[A_d-A_d]=1.972377042307248 I1T[A_d-A_d]=6.477159303699964e-16 I2T[A_d-A_d]=0.0003641960568531389 Memory used: 76 MB Time elapsed: 0 s ***** [NRG] Iteration 6/66 (scale 0.12751743082459868) ***** [1] xi(5)=0.1255632919492426 xi_scaled(5)=0.9846755156317096 zeta(6)=0 Stats: nr=38 min=2 max=474 Safeguard: keep additional 5 states Emax=9.562500410548886 nrkept=1398 nrkeptmult=3376 Total energy=-2.508806071907031 Egs=-0.8760147451770073 Kept: 1398 out of 4436, ratio=0.315 GT[A_d-A_d]=2.78332116755207 I1T[A_d-A_d]=2.045159661482079e-15 I2T[A_d-A_d]=0.0003847176199169302 Memory used: 81 MB Time elapsed: 0 s ***** [NRG] Iteration 7/66 (scale 0.090168440055560212) ***** [1] xi(6)=0.08947082529362729 xi_scaled(6)=0.9922632047143872 zeta(7)=0 Stats: nr=36 min=1 max=626 Emax=9.244405348900731 nrkept=1216 nrkeptmult=2944 Total energy=-2.641472253495833 Egs=-1.471315035582918 Kept: 1216 out of 5253, ratio=0.231 GT[A_d-A_d]=3.92340330786803 I1T[A_d-A_d]=4.156495439564515e-15 I2T[A_d-A_d]=0.0004087920186648818 Memory used: 75 MB Time elapsed: 1 s ***** [NRG] Iteration 8/66 (scale 0.063758715412299341) ***** [1] xi(7)=0.06351086930807648 xi_scaled(7)=0.9961127494081373 zeta(8)=0 Stats: nr=38 min=2 max=491 Safeguard: keep additional 5 states Emax=9.565874161593905 nrkept=1398 nrkeptmult=3376 Total energy=-2.699872497621822 Egs=-0.9159570381608215 Kept: 1398 out of 4570, ratio=0.306 GT[A_d-A_d]=5.52055346012905 I1T[A_d-A_d]=6.238766168799537e-15 I2T[A_d-A_d]=0.0004456116693998602 Memory used: 83 MB Time elapsed: 1 s ***** [NRG] Iteration 9/66 (scale 0.045084220027780106) ***** [1] xi(8)=0.04499637947017967 xi_scaled(8)=0.9980516340851342 zeta(9)=0 Stats: nr=36 min=1 max=626 Emax=9.261289615022303 nrkept=1216 nrkeptmult=2944 Total energy=-2.764852210879696 Egs=-1.441296161225247 Kept: 1216 out of 5253, ratio=0.231 GT[A_d-A_d]=7.745664334430524 I1T[A_d-A_d]=8.436837525110772e-15 I2T[A_d-A_d]=0.000491198048075762 Memory used: 89 MB Time elapsed: 2 s ***** [NRG] Iteration 10/66 (scale 0.031879357706149671) ***** [1] xi(9)=0.03184826348698654 xi_scaled(9)=0.9990246284304175 zeta(10)=0 Stats: nr=38 min=2 max=491 Safeguard: keep additional 2 states Emax=9.585025879410098 nrkept=1395 nrkeptmult=3369 Total energy=-2.795086869569136 Egs=-0.9484086526501045 Kept: 1395 out of 4570, ratio=0.305 GT[A_d-A_d]=10.8148595795212 I1T[A_d-A_d]=1.181184050196888e-14 I2T[A_d-A_d]=0.0005543343478376652 Memory used: 89 MB Time elapsed: 2 s ***** [NRG] Iteration 11/66 (scale 0.022542110013890053) ***** [1] xi(10)=0.02253110983902919 xi_scaled(10)=0.9995120166278095 zeta(11)=0 Stats: nr=36 min=1 max=625 Emax=9.299196382928251 nrkept=1216 nrkeptmult=2944 Total energy=-2.826770682398231 Egs=-1.405538914040118 Kept: 1216 out of 5241, ratio=0.232 GT[A_d-A_d]=14.97872895650842 I1T[A_d-A_d]=1.454116887139009e-14 I2T[A_d-A_d]=0.0006296900019968076 Memory used: 81 MB Time elapsed: 2 s ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** [1] xi(11)=0.01593578851722613 xi_scaled(11)=0.9997559338626226 zeta(12)=0 Stats: nr=38 min=2 max=491 Safeguard: keep additional 2 states Emax=9.000068511512922 nrkept=1307 nrkeptmult=3177 Total energy=-2.842369317629224 Egs=-0.9786041095792581 Kept: 1307 out of 4570, ratio=0.286 GT[A_d-A_d]=20.46004756552783 I1T[A_d-A_d]=1.727770907784758e-14 I2T[A_d-A_d]=0.0007199271243877353 Memory used: 86 MB Time elapsed: 3 s ***** [NRG] Iteration 13/66 (scale 0.011271055006945026) ***** [1] xi(12)=0.01126967935565226 xi_scaled(12)=0.9998779483116782 zeta(13)=0 Stats: nr=36 min=1 max=586 Safeguard: keep additional 2 states Emax=9.016222679916755 nrkept=1108 nrkeptmult=2696 Total energy=-2.857797048452915 Egs=-1.368792079728544 Kept: 1108 out of 4918, ratio=0.225 GT[A_d-A_d]=27.31588628624623 I1T[A_d-A_d]=1.803342673825062e-14 I2T[A_d-A_d]=0.0008073183612135937 Memory used: 88 MB Time elapsed: 3 s ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** [1] xi(13)=0.007969353023252924 xi_scaled(13)=0.9999389695000788 zeta(14)=0 Stats: nr=38 min=1 max=455 Emax=9.038912279244615 nrkept=1107 nrkeptmult=2703 Total energy=-2.865822969215476 Egs=-1.007036695850666 Kept: 1107 out of 4176, ratio=0.265 GT[A_d-A_d]=35.1401863657775 I1T[A_d-A_d]=1.559490316288374e-14 I2T[A_d-A_d]=0.0008708365695612654 Memory used: 88 MB Time elapsed: 3 s ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** [1] xi(14)=0.005635355527382068 xi_scaled(14)=0.9999694835859927 zeta(15)=0 Stats: nr=34 min=1 max=507 Safeguard: keep additional 1 states Emax=9.034962093279798 nrkept=1027 nrkeptmult=2512 Total energy=-2.873331946660219 Egs=-1.332435595446251 Kept: 1027 out of 4169, ratio=0.246 GT[A_d-A_d]=42.78570008662338 I1T[A_d-A_d]=7.482702820329882e-15 I2T[A_d-A_d]=0.0008663834634688438 Memory used: 88 MB Time elapsed: 4 s ***** [NRG] Iteration 16/66 (scale 0.0039849197132687088) ***** [1] xi(15)=0.00398485890937912 xi_scaled(15)=0.9999847415019714 zeta(16)=0 Stats: nr=38 min=1 max=416 Safeguard: keep additional 1 states Emax=9.00730320160363 nrkept=1071 nrkeptmult=2625 Total energy=-2.877458064498388 Egs=-1.035433116614642 Kept: 1071 out of 3870, ratio=0.277 GT[A_d-A_d]=48.41358534515894 I1T[A_d-A_d]=-5.488700653374402e-15 I2T[A_d-A_d]=0.0007625164756114953 Memory used: 88 MB Time elapsed: 4 s ***** [NRG] Iteration 17/66 (scale 0.0028177637517362566) ***** [1] xi(16)=0.002817742254109917 xi_scaled(16)=0.9999923706782278 zeta(17)=0 Stats: nr=34 min=1 max=484 Safeguard: keep additional 4 states Emax=9.004859674028385 nrkept=896 nrkeptmult=2174 Total energy=-2.881106633478057 Egs=-1.294845594283946 Kept: 896 out of 4032, ratio=0.222 GT[A_d-A_d]=50.75792651640864 I1T[A_d-A_d]=-1.838697511406101e-14 I2T[A_d-A_d]=0.0005650504906673377 Memory used: 88 MB Time elapsed: 4 s ***** [NRG] Iteration 18/66 (scale 0.0019924598566343544) ***** [1] xi(17)=0.00199245225603943 xi_scaled(17)=0.9999961853209243 zeta(18)=0 Stats: nr=38 min=1 max=366 Safeguard: keep additional 1 states Emax=9.004079018975883 nrkept=849 nrkeptmult=2089 Total energy=-2.883233450880623 Egs=-1.067433000210369 Kept: 849 out of 3366, ratio=0.252 GT[A_d-A_d]=50.67623285527298 I1T[A_d-A_d]=-2.2905100311967e-14 I2T[A_d-A_d]=0.0003438976225836675 Memory used: 88 MB Time elapsed: 4 s ***** [NRG] Iteration 19/66 (scale 0.0014088818758681283) ***** [1] xi(18)=0.001408879188645615 xi_scaled(18)=0.9999980926559147 zeta(19)=0 Stats: nr=34 min=1 max=389 Safeguard: keep additional 3 states Emax=9.002718729846915 nrkept=743 nrkeptmult=1840 Total energy=-2.884998518492762 Egs=-1.252814478184181 Kept: 743 out of 3194, ratio=0.233 GT[A_d-A_d]=50.88211843234523 I1T[A_d-A_d]=-1.802360920287547e-14 I2T[A_d-A_d]=0.0001752767582231557 Memory used: 88 MB Time elapsed: 4 s ***** [NRG] Iteration 20/66 (scale 0.0009962299283171772) ***** [1] xi(19)=0.000996228978239414 xi_scaled(19)=0.9999990463268206 zeta(20)=0 Stats: nr=36 min=1 max=303 Safeguard: keep additional 3 states Emax=9.013184435742776 nrkept=723 nrkeptmult=1823 Total energy=-2.886101125929296 Egs=-1.106780076761047 Kept: 723 out of 2798, ratio=0.258 GT[A_d-A_d]=53.62497221666305 I1T[A_d-A_d]=-1.019510200545547e-14 I2T[A_d-A_d]=8.192335124205279e-05 Memory used: 88 MB Time elapsed: 4 s ***** [NRG] Iteration 21/66 (scale 0.00070444093793406415) ***** [1] xi(20)=0.0007044406020306494 xi_scaled(20)=0.999999523163126 zeta(21)=0 Stats: nr=34 min=1 max=335 Safeguard: keep additional 4 states Emax=9.001554793174734 nrkept=647 nrkeptmult=1612 Total energy=-2.886948854187969 Egs=-1.203405726474942 Kept: 647 out of 2734, ratio=0.237 GT[A_d-A_d]=59.26767698523911 I1T[A_d-A_d]=-4.487587754333335e-15 I2T[A_d-A_d]=3.958502324252421e-05 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 22/66 (scale 0.0004981149641585886) ***** [1] xi(21)=0.000498114845398762 xi_scaled(21)=0.9999997615814918 zeta(22)=0 Stats: nr=36 min=1 max=270 Safeguard: keep additional 2 states Emax=9.009661957702022 nrkept=627 nrkeptmult=1597 Total energy=-2.887524811334331 Egs=-1.156273526804579 Kept: 627 out of 2438, ratio=0.257 GT[A_d-A_d]=67.65213554429299 I1T[A_d-A_d]=-1.418016427630326e-15 I2T[A_d-A_d]=2.069517362051623e-05 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 23/66 (scale 0.00035222046896703208) ***** [1] xi(22)=0.0003522204269790865 xi_scaled(22)=0.9999998807907282 zeta(23)=0 Stats: nr=33 min=1 max=290 Emax=9.001961040122595 nrkept=610 nrkeptmult=1538 Total energy=-2.887928102902267 Egs=-1.144997532705835 Kept: 610 out of 2377, ratio=0.257 GT[A_d-A_d]=78.4101794232685 I1T[A_d-A_d]=-1.20440408863477e-16 I2T[A_d-A_d]=1.153025846305062e-05 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 24/66 (scale 0.0002490574820792943) ***** [1] xi(23)=0.0002490574672343127 xi_scaled(23)=0.9999999403953597 zeta(24)=0 Stats: nr=36 min=1 max=259 Safeguard: keep additional 3 states Emax=9.004667028620045 nrkept=596 nrkeptmult=1476 Total energy=-2.888231356679975 Egs=-1.217605571118466 Kept: 596 out of 2306, ratio=0.258 GT[A_d-A_d]=91.84549088467752 I1T[A_d-A_d]=5.137901217115205e-16 I2T[A_d-A_d]=6.605256380525918e-06 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 25/66 (scale 0.00017611023448351604) ***** [1] xi(24)=0.0001761102292350223 xi_scaled(24)=0.9999999701976788 zeta(25)=0 Stats: nr=33 min=1 max=284 Emax=9.004544877420342 nrkept=588 nrkeptmult=1466 Total energy=-2.888421231343979 Egs=-1.078158033011477 Kept: 588 out of 2253, ratio=0.261 GT[A_d-A_d]=107.985981119537 I1T[A_d-A_d]=7.321915320512927e-16 I2T[A_d-A_d]=3.854428446157677e-06 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 26/66 (scale 0.00012452874103964715) ***** [1] xi(25)=0.0001245287391840243 xi_scaled(25)=0.9999999850988391 zeta(26)=0 Stats: nr=36 min=1 max=249 Safeguard: keep additional 1 states Emax=9.001531897590258 nrkept=556 nrkeptmult=1346 Total energy=-2.88858192225226 Egs=-1.290392137099927 Kept: 556 out of 2218, ratio=0.251 GT[A_d-A_d]=127.1617123636242 I1T[A_d-A_d]=8.313152847710413e-16 I2T[A_d-A_d]=2.273641178576119e-06 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 27/66 (scale 8.8055117241758019e-05) ***** [1] xi(26)=8.805511658569628e-05 xi_scaled(26)=0.9999999925494195 zeta(27)=0 Stats: nr=33 min=1 max=271 Safeguard: keep additional 2 states Emax=9.000411010961971 nrkept=570 nrkeptmult=1406 Total energy=-2.888670602684024 Egs=-1.0071013990126 Kept: 570 out of 2093, ratio=0.272 GT[A_d-A_d]=149.3565828555556 I1T[A_d-A_d]=7.959642985429341e-16 I2T[A_d-A_d]=1.346915650185236e-06 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 28/66 (scale 6.2264370519823575e-05) ***** [1] xi(27)=6.226437028787072e-05 xi_scaled(27)=0.9999999962747097 zeta(28)=0 Stats: nr=36 min=1 max=239 Safeguard: keep additional 1 states Emax=9.006331688104064 nrkept=521 nrkeptmult=1257 Total energy=-2.888755901240138 Egs=-1.369941676141849 Kept: 521 out of 2148, ratio=0.243 GT[A_d-A_d]=174.0329965621559 I1T[A_d-A_d]=6.789480468385122e-16 I2T[A_d-A_d]=8.02527026020962e-07 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 29/66 (scale 4.402755862087901e-05) ***** [1] xi(28)=4.402755853887129e-05 xi_scaled(28)=0.9999999981373549 zeta(29)=0 Stats: nr=33 min=1 max=254 Safeguard: keep additional 2 states Emax=9.008068492752418 nrkept=541 nrkeptmult=1318 Total energy=-2.888797296530698 Egs=-0.9402131723007678 Kept: 541 out of 1958, ratio=0.276 GT[A_d-A_d]=200.7113429412551 I1T[A_d-A_d]=5.104126969483522e-16 I2T[A_d-A_d]=4.743886640103892e-07 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 30/66 (scale 3.1132185259911788e-05) ***** [1] xi(29)=3.113218523091768e-05 xi_scaled(29)=0.9999999990686774 zeta(30)=0 Stats: nr=36 min=1 max=230 Safeguard: keep additional 2 states Emax=9.028516733429479 nrkept=492 nrkeptmult=1192 Total energy=-2.888842316871554 Egs=-1.446102818681152 Kept: 492 out of 2038, ratio=0.241 GT[A_d-A_d]=227.0686322280925 I1T[A_d-A_d]=3.407427298817328e-16 I2T[A_d-A_d]=2.803345640338633e-07 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 31/66 (scale 2.2013779310439505e-05) ***** [1] xi(30)=2.201377930018854e-05 xi_scaled(30)=0.9999999995343387 zeta(31)=0 Stats: nr=33 min=1 max=236 Safeguard: keep additional 4 states Emax=9.0410802953591 nrkept=512 nrkeptmult=1220 Total energy=-2.888861831946415 Egs=-0.8864936177391678 Kept: 512 out of 1846, ratio=0.277 GT[A_d-A_d]=252.4258529528361 I1T[A_d-A_d]=2.105566014638867e-16 I2T[A_d-A_d]=1.616722217683487e-07 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 32/66 (scale 1.5566092629955894e-05) ***** [1] xi(31)=1.556609262633163e-05 xi_scaled(31)=0.9999999997671692 zeta(32)=0 Stats: nr=34 min=1 max=220 Emax=9.003690150723102 nrkept=448 nrkeptmult=1060 Total energy=-2.888885298983614 Egs=-1.507574042890487 Kept: 448 out of 1922, ratio=0.233 GT[A_d-A_d]=273.0973646408607 I1T[A_d-A_d]=1.190900927617659e-16 I2T[A_d-A_d]=9.229425631540603e-08 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 33/66 (scale 1.1006889655219752e-05) ***** [1] xi(32)=1.100688965393838e-05 xi_scaled(32)=0.9999999998835847 zeta(33)=0 Stats: nr=31 min=1 max=221 Safeguard: keep additional 1 states Emax=9.006810280438089 nrkept=472 nrkeptmult=1130 Total energy=-2.888894651878025 Egs=-0.8497309143971674 Kept: 472 out of 1678, ratio=0.281 GT[A_d-A_d]=290.3727769979248 I1T[A_d-A_d]=7.405001576402489e-17 I2T[A_d-A_d]=5.075549163541797e-08 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 34/66 (scale 7.7830463149779469e-06) ***** [1] xi(33)=7.783046314524915e-06 xi_scaled(33)=0.9999999999417925 zeta(34)=0 Stats: nr=34 min=1 max=201 Safeguard: keep additional 3 states Emax=9.032503041525237 nrkept=408 nrkeptmult=958 Total energy=-2.888906711348111 Egs=-1.549453722565269 Kept: 408 out of 1770, ratio=0.231 GT[A_d-A_d]=300.9734131157408 I1T[A_d-A_d]=3.390072023862006e-17 I2T[A_d-A_d]=2.752932008351985e-08 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 35/66 (scale 5.5034448276098762e-06) ***** [1] xi(34)=5.503444827449705e-06 xi_scaled(34)=0.9999999999708962 zeta(35)=0 Stats: nr=31 min=1 max=205 Safeguard: keep additional 1 states Emax=9.000123069930094 nrkept=407 nrkeptmult=946 Total energy=-2.888911265770376 Egs=-0.8275584489880558 Kept: 407 out of 1530, ratio=0.266 GT[A_d-A_d]=309.3979466187136 I1T[A_d-A_d]=1.733623656634357e-17 I2T[A_d-A_d]=1.435826773518829e-08 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 36/66 (scale 3.8915231574889735e-06) ***** [1] xi(35)=3.891523157432344e-06 xi_scaled(35)=0.9999999999854481 zeta(36)=0 Stats: nr=28 min=1 max=177 Safeguard: keep additional 1 states Emax=9.012039080253622 nrkept=380 nrkeptmult=892 Total energy=-2.888917392961342 Egs=-1.574496853362022 Kept: 380 out of 1520, ratio=0.25 GT[A_d-A_d]=312.541984345561 I1T[A_d-A_d]=2.33377098431016e-18 I2T[A_d-A_d]=7.469894864733123e-09 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 37/66 (scale 2.7517224138049381e-06) ***** [1] xi(36)=2.751722413784917e-06 xi_scaled(36)=0.999999999992724 zeta(37)=0 Stats: nr=31 min=1 max=190 Emax=9.050800436092498 nrkept=375 nrkeptmult=844 Total energy=-2.888919636307615 Egs=-0.8152516623210139 Kept: 375 out of 1423, ratio=0.264 GT[A_d-A_d]=316.2096480679709 I1T[A_d-A_d]=3.425775124333265e-18 I2T[A_d-A_d]=3.769004333268217e-09 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 38/66 (scale 1.9457615787444867e-06) ***** [1] xi(37)=1.945761578737408e-06 xi_scaled(37)=0.999999999996362 zeta(38)=0 Stats: nr=28 min=1 max=167 Safeguard: keep additional 1 states Emax=9.016614694255278 nrkept=344 nrkeptmult=792 Total energy=-2.888922726732151 Egs=-1.588285312165731 Kept: 344 out of 1396, ratio=0.246 GT[A_d-A_d]=316.0934454700307 I1T[A_d-A_d]=-2.216678605519604e-20 I2T[A_d-A_d]=1.920173153373929e-09 Memory used: 88 MB Time elapsed: 5 s ***** [NRG] Iteration 39/66 (scale 1.3758612069024691e-06) ***** [1] xi(38)=1.375861206899966e-06 xi_scaled(38)=0.9999999999981811 zeta(39)=0 Stats: nr=31 min=1 max=174 Emax=9.281250833398591 nrkept=375 nrkeptmult=844 Total energy=-2.888923839454391 Egs=-0.8087459946906739 Kept: 375 out of 1283, ratio=0.292 GT[A_d-A_d]=318.2067237213306 I1T[A_d-A_d]=2.109337858970435e-18 I2T[A_d-A_d]=9.568548723052349e-10 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 40/66 (scale 9.7288078937224336e-07) ***** [1] xi(39)=9.728807893713586e-07 xi_scaled(39)=0.9999999999990906 zeta(40)=0 Stats: nr=28 min=1 max=167 Safeguard: keep additional 1 states Emax=9.039182610095278 nrkept=329 nrkeptmult=739 Total energy=-2.888925391717607 Egs=-1.595532806564012 Kept: 329 out of 1396, ratio=0.236 GT[A_d-A_d]=317.0271216850138 I1T[A_d-A_d]=-6.882639004808722e-20 I2T[A_d-A_d]=4.83531617700265e-10 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 41/66 (scale 6.8793060345123453e-07) ***** [1] xi(40)=6.879306034509217e-07 xi_scaled(40)=0.9999999999995453 zeta(41)=0 Stats: nr=29 min=2 max=170 Emax=9.41107431424048 nrkept=375 nrkeptmult=844 Total energy=-2.888925945775457 Egs=-0.805397880632993 Kept: 375 out of 1223, ratio=0.307 GT[A_d-A_d]=318.7466662205359 I1T[A_d-A_d]=3.368622734270138e-19 I2T[A_d-A_d]=2.402117332416077e-10 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 42/66 (scale 4.8644039468612168e-07) ***** [1] xi(41)=4.86440394686011e-07 xi_scaled(41)=0.9999999999997725 zeta(42)=0 Stats: nr=28 min=1 max=167 Safeguard: keep additional 1 states Emax=9.16670163947478 nrkept=329 nrkeptmult=739 Total energy=-2.888926723715209 Egs=-1.599249898962172 Kept: 329 out of 1396, ratio=0.236 GT[A_d-A_d]=317.2689216495501 I1T[A_d-A_d]=-9.718987558513238e-19 I2T[A_d-A_d]=1.211905804423273e-10 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 43/66 (scale 3.4396530172561726e-07) ***** [1] xi(42)=3.439653017255781e-07 xi_scaled(42)=0.9999999999998863 zeta(43)=0 Stats: nr=29 min=2 max=170 Emax=9.478264361976255 nrkept=375 nrkeptmult=844 Total energy=-2.888927000159775 Egs=-0.8036989904965645 Kept: 375 out of 1223, ratio=0.307 GT[A_d-A_d]=318.8933555662416 I1T[A_d-A_d]=-2.948069635187459e-19 I2T[A_d-A_d]=6.01180207984025e-11 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 44/66 (scale 2.4322019734306084e-07) ***** [1] xi(43)=2.43220197343047e-07 xi_scaled(43)=0.9999999999999432 zeta(44)=0 Stats: nr=28 min=1 max=167 Emax=9.197306622349142 nrkept=328 nrkeptmult=738 Total energy=-2.888927389587522 Egs=-1.601132438121995 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3262556104884 I1T[A_d-A_d]=-1.743097025317681e-19 I2T[A_d-A_d]=3.031613612644056e-11 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 45/66 (scale 1.7198265086280863e-07) ***** [1] xi(44)=1.719826508628037e-07 xi_scaled(44)=0.9999999999999716 zeta(45)=0 Stats: nr=29 min=2 max=169 Emax=9.512399734892035 nrkept=375 nrkeptmult=844 Total energy=-2.888927527662625 Egs=-0.8028432020595003 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9349147778452 I1T[A_d-A_d]=5.290867434727257e-19 I2T[A_d-A_d]=1.503376720355476e-11 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 46/66 (scale 1.2161009867153042e-07) ***** [1] xi(45)=1.216100986715287e-07 xi_scaled(45)=0.9999999999999859 zeta(46)=0 Stats: nr=28 min=1 max=167 Emax=9.206161950081533 nrkept=328 nrkeptmult=738 Total energy=-2.888927722491706 Egs=-1.602079788581884 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3390916690752 I1T[A_d-A_d]=4.116369192599699e-19 I2T[A_d-A_d]=7.581084122635596e-12 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 47/66 (scale 8.5991325431404316e-08) ***** [1] xi(46)=8.599132543140371e-08 xi_scaled(46)=0.9999999999999929 zeta(47)=0 Stats: nr=29 min=2 max=169 Emax=9.529082027707783 nrkept=375 nrkeptmult=844 Total energy=-2.888927791492324 Egs=-0.8024137047060309 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.947630386261 I1T[A_d-A_d]=4.793501826975021e-19 I2T[A_d-A_d]=3.758697294655829e-12 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 48/66 (scale 6.080504933576521e-08) ***** [1] xi(47)=6.0805049335765e-08 xi_scaled(47)=0.9999999999999966 zeta(48)=0 Stats: nr=28 min=1 max=167 Emax=9.210604081669493 nrkept=328 nrkeptmult=738 Total energy=-2.888927888935759 Egs=-1.60255499456817 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3412726689755 I1T[A_d-A_d]=1.821367956804746e-19 I2T[A_d-A_d]=1.895468975737851e-12 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 49/66 (scale 4.2995662715702158e-08) ***** [1] xi(48)=4.299566271570209e-08 xi_scaled(48)=0.9999999999999983 zeta(49)=0 Stats: nr=29 min=2 max=169 Emax=9.535963770926811 nrkept=375 nrkeptmult=844 Total energy=-2.888927923426818 Egs=-0.8021985531002416 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9516452205275 I1T[A_d-A_d]=1.329021525913117e-19 I2T[A_d-A_d]=9.396846149917606e-13 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 50/66 (scale 3.0402524667882605e-08) ***** [1] xi(49)=3.040252466788258e-08 xi_scaled(49)=0.9999999999999991 zeta(50)=0 Stats: nr=28 min=1 max=167 Emax=9.212829233100368 nrkept=328 nrkeptmult=738 Total energy=-2.888927972155771 Egs=-1.602792981621725 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3409721229856 I1T[A_d-A_d]=1.769450482645738e-20 I2T[A_d-A_d]=4.73888032699179e-13 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 51/66 (scale 2.1497831357851079e-08) ***** [1] xi(50)=2.149783135785107e-08 xi_scaled(50)=0.9999999999999996 zeta(51)=0 Stats: nr=29 min=2 max=169 Safeguard: keep additional 1 states Emax=9.538701910126031 nrkept=376 nrkeptmult=850 Total energy=-2.888927989398986 Egs=-0.802090876302371 Kept: 376 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9540328412754 I1T[A_d-A_d]=2.955655915380336e-20 I2T[A_d-A_d]=2.349255497469152e-13 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 52/66 (scale 1.5201262333941303e-08) ***** [1] xi(51)=1.52012623339413e-08 xi_scaled(51)=0.9999999999999998 zeta(52)=0 Stats: nr=28 min=1 max=167 Emax=9.213943105339226 nrkept=328 nrkeptmult=738 Total energy=-2.888928013765272 Egs=-1.602912071329341 Kept: 328 out of 1400, ratio=0.234 GT[A_d-A_d]=317.3401972522618 I1T[A_d-A_d]=8.628023701507995e-21 I2T[A_d-A_d]=1.184742393608572e-13 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 53/66 (scale 1.0748915678925539e-08) ***** [1] xi(52)=1.074891567892554e-08 xi_scaled(52)=0.9999999999999999 zeta(53)=0 Stats: nr=29 min=2 max=169 Safeguard: keep additional 1 states Emax=9.540062874224079 nrkept=376 nrkeptmult=850 Total energy=-2.888928022386301 Egs=-0.8020370126320765 Kept: 376 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9541056817373 I1T[A_d-A_d]=2.526988949970336e-20 I2T[A_d-A_d]=5.873145741792137e-14 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 54/66 (scale 7.6006311669706513e-09) ***** [1] xi(53)=7.600631166970651e-09 xi_scaled(53)=1 zeta(54)=0 Stats: nr=28 min=1 max=167 Emax=9.214499953337098 nrkept=328 nrkeptmult=738 Total energy=-2.888928034569897 Egs=-1.602971640243802 Kept: 328 out of 1400, ratio=0.234 GT[A_d-A_d]=317.3393905812476 I1T[A_d-A_d]=1.066821298358175e-20 I2T[A_d-A_d]=2.961879463698579e-14 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 55/66 (scale 5.3744578394627697e-09) ***** [1] xi(54)=5.37445783946277e-09 xi_scaled(54)=1 zeta(55)=0 Stats: nr=29 min=2 max=169 Emax=9.540725762560138 nrkept=375 nrkeptmult=844 Total energy=-2.888928038880267 Egs=-0.8020100744814886 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9524948116368 I1T[A_d-A_d]=1.499139813808199e-20 I2T[A_d-A_d]=1.468264205881254e-14 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 56/66 (scale 3.8003155834853256e-09) ***** [1] xi(55)=3.800315583485326e-09 xi_scaled(55)=1 zeta(56)=0 Stats: nr=28 min=1 max=167 Emax=9.214778089785717 nrkept=328 nrkeptmult=738 Total energy=-2.888928044972178 Egs=-1.603001430715643 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3386168808501 I1T[A_d-A_d]=6.710948621385391e-21 I2T[A_d-A_d]=7.404718800292077e-15 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 57/66 (scale 2.6872289197313849e-09) ***** [1] xi(56)=2.687228919731385e-09 xi_scaled(56)=1 zeta(57)=0 Stats: nr=29 min=2 max=169 Emax=9.541047404435073 nrkept=375 nrkeptmult=844 Total energy=-2.888928047127326 Egs=-0.8019966038300383 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9519454032277 I1T[A_d-A_d]=8.390160807784983e-21 I2T[A_d-A_d]=3.670654652509593e-15 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 58/66 (scale 1.9001577917426628e-09) ***** [1] xi(57)=1.900157791742663e-09 xi_scaled(57)=1 zeta(58)=0 Stats: nr=28 min=1 max=167 Emax=9.214917354463502 nrkept=328 nrkeptmult=738 Total energy=-2.88892805017331 Egs=-1.603016327454208 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3378614396784 I1T[A_d-A_d]=3.851448251687797e-21 I2T[A_d-A_d]=1.851180031042299e-15 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 59/66 (scale 1.3436144598656924e-09) ***** [1] xi(58)=1.343614459865692e-09 xi_scaled(58)=1 zeta(59)=0 Stats: nr=29 min=2 max=169 Emax=9.541207663331551 nrkept=375 nrkeptmult=844 Total energy=-2.888928051250875 Egs=-0.8019898681119609 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.9513058359142 I1T[A_d-A_d]=2.552780344534512e-21 I2T[A_d-A_d]=9.176618738772388e-16 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 60/66 (scale 9.5007889587133141e-10) ***** [1] xi(59)=9.500788958713314e-10 xi_scaled(59)=1 zeta(60)=0 Stats: nr=28 min=1 max=167 Emax=9.214986990012346 nrkept=328 nrkeptmult=738 Total energy=-2.888928052773875 Egs=-1.603023776198311 Kept: 328 out of 1396, ratio=0.235 GT[A_d-A_d]=317.3371217993913 I1T[A_d-A_d]=-7.280837289343214e-22 I2T[A_d-A_d]=4.627945194149654e-16 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 61/66 (scale 6.7180722993284622e-10) ***** [1] xi(60)=6.718072299328462e-10 xi_scaled(60)=1 zeta(61)=0 Stats: nr=29 min=2 max=169 Emax=9.541287670978427 nrkept=375 nrkeptmult=844 Total energy=-2.888928053312655 Egs=-0.8019865001556825 Kept: 375 out of 1219, ratio=0.308 GT[A_d-A_d]=318.950622823986 I1T[A_d-A_d]=3.872037294122124e-23 I2T[A_d-A_d]=2.294149831790956e-16 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 62/66 (scale 4.750394479356657e-10) ***** [1] xi(61)=4.750394479356657e-10 xi_scaled(61)=1 zeta(62)=0 Stats: nr=28 min=1 max=167 Safeguard: keep additional 3 states Emax=9.215029993457609 nrkept=331 nrkeptmult=741 Total energy=-2.888928054074156 Egs=-1.603027500663692 Kept: 331 out of 1396, ratio=0.237 GT[A_d-A_d]=317.3380403099467 I1T[A_d-A_d]=-5.498715433688929e-22 I2T[A_d-A_d]=1.15699689262349e-16 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 63/66 (scale 3.3590361496642311e-10) ***** [1] xi(62)=3.359036149664231e-10 xi_scaled(62)=1 zeta(63)=0 Stats: nr=29 min=2 max=170 Emax=9.541327645161541 nrkept=375 nrkeptmult=844 Total energy=-2.888928054343545 Egs=-0.8019848161536616 Kept: 375 out of 1228, ratio=0.305 GT[A_d-A_d]=318.9499863550197 I1T[A_d-A_d]=1.671440000595218e-22 I2T[A_d-A_d]=5.735364778630154e-17 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 64/66 (scale 2.3751972396783285e-10) ***** [1] xi(63)=2.375197239678329e-10 xi_scaled(63)=1 zeta(64)=0 Stats: nr=28 min=1 max=167 Safeguard: keep additional 3 states Emax=9.215043398146584 nrkept=331 nrkeptmult=741 Total energy=-2.888928054724296 Egs=-1.603029362920385 Kept: 331 out of 1396, ratio=0.237 GT[A_d-A_d]=317.3373152865512 I1T[A_d-A_d]=-1.830217884630268e-23 I2T[A_d-A_d]=2.892486573482485e-17 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 65/66 (scale 1.6795180748321155e-10) ***** [1] xi(64)=1.679518074832116e-10 xi_scaled(64)=1 zeta(65)=0 Stats: nr=29 min=2 max=170 Safeguard: keep additional 9 states Emax=9.541362338255611 nrkept=384 nrkeptmult=860 Total energy=-2.888928054858991 Egs=-0.8019839741470527 Kept: 384 out of 1228, ratio=0.313 GT[A_d-A_d]=318.9526685415462 I1T[A_d-A_d]=1.645887470588788e-22 I2T[A_d-A_d]=1.43389321956406e-17 Memory used: 88 MB Time elapsed: 6 s ***** [NRG] Iteration 66/66 (scale 1.1875986198391643e-10) ***** [1] xi(65)=1.187598619839164e-10 xi_scaled(65)=1 zeta(66)=0 Stats: nr=28 min=1 max=171 Safeguard: keep additional 3 states Emax=9.215049594069459 nrkept=331 nrkeptmult=741 Total energy=-2.888928055049366 Egs=-1.603030294055363 Kept: 331 out of 1428, ratio=0.232 GT[A_d-A_d]=317.3366324762085 I1T[A_d-A_d]=-1.679481585554168e-22 I2T[A_d-A_d]=7.231206196754981e-18 Memory used: 88 MB Time elapsed: 6 s ** Iteration completed. Spectrum: A_d-A_d GT Spectrum: A_d-A_d I1T Spectrum: A_d-A_d I2T Total energy: -2.888928055049366 TKW=2.141716528499401e-05 Memory usage report =================== after diag: 92132 kB after recalc: 93284 kB after split: 93284 kB after trim: 92132 kB after trunc: 92132 kB diag_h: 92132 kB Peak usage: 93284 kB Timing report ============= All: 6 s diag: 5 s recalc d: 0 s recalc f: 0 s spec gt: 0 s spec i1t: 0 s spec i2t: 0 s Other: 0 s