NRG Ljubljana 2.4.3.31 - (c) Rok Zitko <rok.zitko@ijs.si>
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=3
strategy=kept
lastall=0
lastalloverride=0
z=0.25
discretization=Z
band=flat
bandrescale=1
betabar=1
T=-999
keep=5000
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=n_d n_d^2 n_d_ud flm hop0
specs=
specd=
spect=
specq=
specot=
reim=0
specgt=
gtp=0.7
speci1t=
speci2t=
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=43 subspaces=6
Reading <||||> (e)
Reading <||n_d||> (s)
Reading <||n_d_ud||> (s)
Reading <||flm||> (s)
Reading <||n_d^2||> (s)
Reading <||hop0||> (s)
Reading <||||> (z)

length_coef_table=43 Nmax=43

Number of invariant subspaces: 6
(-2 1) 1 states
0.01739151815801416 
(-1 2) 2 states
0.008124231866447708 0.02457189239551712 
(0 1) 3 states
0 0.01739151815801416 0.03269612426196481 
(0 3) 1 states
0.01530460610395066 
(1 2) 2 states
0.00812423186644771 0.02457189239551712 
(2 1) 1 states
0.01739151815801416 
Number of states (multiplicity taken into account): 16

Computing the following operators:
s=[]
p=[]
g=[]
d=[]
v=[]
t=[]
q=[]
ot=[]

Computing the following spectra:

Before NRG iteration (N=-1)
<flm>=0.5005217162519894
<hop0>=-0.008157315579369061
<n_d>=1
<n_d^2>=1.499478283748011
<n_d_ud>=0.2497391418740054

 ***** [NRG] Iteration 1/43 (scale 1.3832644937419567) ***** 
[1] xi(0)=0.5806542566913844 xi_scaled(0)=0.4197709543751966 zeta(1)=0
Stats: nr=10 min=1 max=8
Emax=1.683641206402866 nrkept=35 nrkeptmult=64 
Total energy=-1.161960550508979  Egs=-0.8135049289852787
Kept: 35 out of 35, ratio=1
<flm>=0.5009035993554636
<hop0>=-0.01392484878477164
<n_d>=1
<n_d^2>=1.499096400644537
<n_d_ud>=0.2495482003222684
Memory used: 43 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/43 (scale 0.79862812782237003) ***** 
[1] xi(1)=0.598351797711507 xi_scaled(1)=0.7492245475288241 zeta(2)=0
Stats: nr=15 min=1 max=20
Emax=4.247120694688876 nrkept=126 nrkeptmult=256 
Total energy=-1.693435024517511  Egs=-0.6654842917412771
Kept: 126 out of 126, ratio=1
<flm>=0.5015648813950578
<hop0>=-0.02349869630388152
<n_d>=1
<n_d^2>=1.498435118604943
<n_d_ud>=0.2492175593024712
Memory used: 43 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/43 (scale 0.46108816458065222) ***** 
[1] xi(2)=0.5775130189624341 xi_scaled(2)=1.25250020131761 zeta(3)=0
Stats: nr=21 min=1 max=75
Safeguard: keep additional 1 states
Emax=9.015956045335987 nrkept=424 nrkeptmult=954 
Total energy=-2.608087795689333  Egs=-1.983683038153182
Kept: 424 out of 462, ratio=0.918
<flm>=0.5027217549333015
<hop0>=-0.03809267239600173
<n_d>=0.9999999999999989
<n_d^2>=1.497278245066696
<n_d_ud>=0.2486391225333488
Memory used: 60 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/43 (scale 0.26620937594079003) ***** 
[1] xi(3)=0.3317798913964639 xi_scaled(3)=1.246311818372085 zeta(4)=0
Stats: nr=28 min=1 max=188
Safeguard: keep additional 7 states
Emax=9.019272662321512 nrkept=620 nrkeptmult=1468 
Total energy=-2.85030134421005  Egs=-0.9098610733176788
Kept: 620 out of 1578, ratio=0.393
<flm>=0.5048091064225482
<hop0>=-0.05773678944904394
<n_d>=1.000000000000002
<n_d^2>=1.495190893577456
<n_d_ud>=0.2475954467887271
Memory used: 62 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/43 (scale 0.1536960548602174) ***** 
[1] xi(4)=0.1629877008547759 xi_scaled(4)=1.060454681175838 zeta(5)=0
Stats: nr=33 min=1 max=290
Emax=9.026613975562579 nrkept=411 nrkeptmult=930 
Total energy=-3.10467737122212  Egs=-1.655058922907414
Kept: 411 out of 2318, ratio=0.177
<flm>=0.5081253136234607
<hop0>=-0.0790514185985708
<n_d>=0.999999999999998
<n_d^2>=1.491874686376536
<n_d_ud>=0.2459373431882689
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/43 (scale 0.088736458646930014) ***** 
[1] xi(5)=0.08983755969353419 xi_scaled(5)=1.012408665653261 zeta(6)=0
Stats: nr=28 min=1 max=182
Safeguard: keep additional 5 states
Emax=10.29193617838578 nrkept=418 nrkeptmult=972 
Total energy=-3.169326613069315  Egs=-0.7285533233236751
Kept: 418 out of 1532, ratio=0.273
<flm>=0.5140002381160329
<hop0>=-0.1003374861032348
<n_d>=0.9999999999999951
<n_d^2>=1.485999761883958
<n_d_ud>=0.2429998809419812
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/43 (scale 0.051232018286739137) ***** 
[1] xi(6)=0.05141277983996145 xi_scaled(6)=1.003528292643296 zeta(7)=0
Stats: nr=33 min=1 max=203
Safeguard: keep additional 1 states
Emax=9.004404079930485 nrkept=304 nrkeptmult=686 
Total energy=-3.250071146395392  Egs=-1.576056068573356
Kept: 304 out of 1563, ratio=0.194
<flm>=0.5241227887685127
<hop0>=-0.1217207044938802
<n_d>=0.9999999999999918
<n_d^2>=1.47587721123147
<n_d_ud>=0.2379386056157395
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/43 (scale 0.029578819548976672) ***** 
[1] xi(7)=0.0296123378288679 xi_scaled(7)=1.001133185177851 zeta(8)=0
Stats: nr=28 min=1 max=134
Safeguard: keep additional 1 states
Emax=9.045496333646309 nrkept=404 nrkeptmult=944 
Total energy=-3.272427777782644  Egs=-0.7558324411910491
Kept: 404 out of 1132, ratio=0.357
<flm>=0.5413231352134589
<hop0>=-0.1427184035889484
<n_d>=0.999999999999989
<n_d^2>=1.458676864786518
<n_d_ud>=0.229338432393265
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/43 (scale 0.017077339428913048) ***** 
[1] xi(8)=0.01708372015449475 xi_scaled(8)=1.000373636982989 zeta(9)=0
Stats: nr=33 min=1 max=195
Safeguard: keep additional 1 states
Emax=9.012059390333633 nrkept=304 nrkeptmult=686 
Total energy=-3.298351508439493  Egs=-1.518019288939027
Kept: 304 out of 1510, ratio=0.201
<flm>=0.5701222489551432
<hop0>=-0.1633872242351781
<n_d>=0.9999999999999859
<n_d^2>=1.429877751044828
<n_d_ud>=0.2149388755224215
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/43 (scale 0.0098596065163255569) ***** 
[1] xi(9)=0.009860830171256441 xi_scaled(9)=1.000124107886948 zeta(10)=0
Stats: nr=28 min=1 max=134
Safeguard: keep additional 1 states
Emax=9.279670124731226 nrkept=334 nrkeptmult=772 
Total energy=-3.306132211816464  Egs=-0.7891494821916089
Kept: 334 out of 1132, ratio=0.295
<flm>=0.6170467015331587
<hop0>=-0.1828269125999295
<n_d>=0.9999999999999782
<n_d^2>=1.382953298466798
<n_d_ud>=0.1914766492334099
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/43 (scale 0.0056924464763043487) ***** 
[1] xi(10)=0.005692681695001822 xi_scaled(10)=1.000041321196159 zeta(11)=0
Stats: nr=31 min=1 max=169
Safeguard: keep additional 1 states
Emax=9.033927913674399 nrkept=284 nrkeptmult=638 
Total energy=-3.314483910118004  Egs=-1.46715447150978
Kept: 284 out of 1246, ratio=0.228
<flm>=0.6866029733311595
<hop0>=-0.1997873189595148
<n_d>=0.9999999999999704
<n_d^2>=1.313397026668782
<n_d_ud>=0.1566985133344057
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/43 (scale 0.0032865355054418526) ***** 
[1] xi(11)=0.003286580755800433 xi_scaled(11)=1.000013768407037 zeta(12)=0
Stats: nr=28 min=1 max=124
Safeguard: keep additional 3 states
Emax=9.005161217269581 nrkept=282 nrkeptmult=652 
Total energy=-3.317161845654001  Egs=-0.8148202055211753
Kept: 282 out of 1052, ratio=0.268
<flm>=0.7754836792038439
<hop0>=-0.2116819599751814
<n_d>=0.9999999999999685
<n_d^2>=1.224516320796094
<n_d_ud>=0.1122581603980626
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/43 (scale 0.0018974821587681161) ***** 
[1] xi(12)=0.001897490866082352 xi_scaled(12)=1.000004588878054 zeta(13)=0
Stats: nr=31 min=1 max=147
Safeguard: keep additional 1 states
Emax=9.088238880167347 nrkept=228 nrkeptmult=518 
Total energy=-3.319864742713113  Egs=-1.424465071580026
Kept: 228 out of 1054, ratio=0.216
<flm>=0.857019229690661
<hop0>=-0.2166639096761175
<n_d>=0.999999999999975
<n_d^2>=1.14298077030929
<n_d_ud>=0.07149038515465743
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 14/43 (scale 0.001095511835147284) ***** 
[1] xi(13)=0.001095513510798785 xi_scaled(13)=1.000001529560382 zeta(14)=0
Stats: nr=26 min=1 max=104
Emax=9.018947471499358 nrkept=219 nrkeptmult=517 
Total energy=-3.320785958563479  Egs=-0.8408999527080022
Kept: 219 out of 850, ratio=0.258
<flm>=0.9012614091185209
<hop0>=-0.2167285054998622
<n_d>=0.9999999999999838
<n_d^2>=1.098738590881448
<n_d_ud>=0.04936929544073187
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 15/43 (scale 0.00063249405292270544) ***** 
[1] xi(14)=0.000632494375397375 xi_scaled(14)=1.000000509846169 zeta(15)=0
Stats: nr=29 min=1 max=113
Safeguard: keep additional 1 states
Emax=9.001126784763594 nrkept=160 nrkeptmult=378 
Total energy=-3.321657829151131  Egs=-1.378464482981974
Kept: 160 out of 823, ratio=0.194
<flm>=0.9136916761076646
<hop0>=-0.2162306593494463
<n_d>=0.999999999999987
<n_d^2>=1.086308323892311
<n_d_ud>=0.04315416194616176
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 16/43 (scale 0.00036517061171576138) ***** 
[1] xi(15)=0.0003651706737757446 xi_scaled(15)=1.000000169947913 zeta(16)=0
Stats: nr=26 min=1 max=72
Safeguard: keep additional 2 states
Emax=9.01189569282745 nrkept=171 nrkeptmult=401 
Total energy=-3.321978406728347  Egs=-0.8778843831654842
Kept: 171 out of 598, ratio=0.286
<flm>=0.9156011776337161
<hop0>=-0.2163514375184392
<n_d>=0.9999999999999882
<n_d^2>=1.084398822366262
<n_d_ud>=0.04219941118313651
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 17/43 (scale 0.00021083135097423514) ***** 
[1] xi(16)=0.0002108313629176655 xi_scaled(16)=1.000000056649214 zeta(17)=0
Stats: nr=27 min=1 max=92
Safeguard: keep additional 1 states
Emax=9.124783258753062 nrkept=149 nrkeptmult=360 
Total energy=-3.322256467635542  Egs=-1.318878363728383
Kept: 149 out of 642, ratio=0.232
<flm>=0.9154648850703534
<hop0>=-0.2167533208075409
<n_d>=0.9999999999999883
<n_d^2>=1.084535114929625
<n_d_ud>=0.04226755746481799
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/43 (scale 0.00012172353723858711) ***** 
[1] xi(17)=0.0001217235395371002 xi_scaled(17)=1.000000018883062 zeta(18)=0
Stats: nr=26 min=1 max=68
Emax=9.008712738767715 nrkept=155 nrkeptmult=355 
Total energy=-3.322369867964458  Egs=-0.9316220304483861
Kept: 155 out of 560, ratio=0.277
<flm>=0.9149483021349506
<hop0>=-0.2171612741993292
<n_d>=0.999999999999989
<n_d^2>=1.085051697865029
<n_d_ud>=0.04252584893251982
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 19/43 (scale 7.0277116991411708e-05) ***** 
[1] xi(18)=7.027711743376066e-05 xi_scaled(18)=1.000000006294353 zeta(19)=0
Stats: nr=27 min=1 max=86
Safeguard: keep additional 1 states
Emax=9.202302821979359 nrkept=149 nrkeptmult=360 
Total energy=-3.322456940984339  Egs=-1.238995331752887
Kept: 149 out of 578, ratio=0.258
<flm>=0.9143718703124771
<hop0>=-0.2175356272858708
<n_d>=0.9999999999999875
<n_d^2>=1.085628129687499
<n_d_ud>=0.04281406484375549
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/43 (scale 4.0574512412862373e-05) ***** 
[1] xi(19)=4.057451249799246e-05 xi_scaled(19)=1.000000002098117 zeta(20)=0
Stats: nr=26 min=1 max=68
Safeguard: keep additional 1 states
Emax=9.093282774325067 nrkept=152 nrkeptmult=348 
Total energy=-3.322497891273146  Egs=-1.009261390260001
Kept: 152 out of 560, ratio=0.271
<flm>=0.913859976623359
<hop0>=-0.2178502235480227
<n_d>=0.9999999999999873
<n_d^2>=1.086140023376617
<n_d_ud>=0.04307001168831477
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 21/43 (scale 2.3425705663803904e-05) ***** 
[1] xi(20)=2.34257056801872e-05 xi_scaled(20)=1.000000000699373 zeta(21)=0
Stats: nr=27 min=1 max=83
Safeguard: keep additional 1 states
Emax=9.056206368119371 nrkept=147 nrkeptmult=354 
Total energy=-3.322524418652651  Egs=-1.132404713261569
Kept: 147 out of 566, ratio=0.26
<flm>=0.9134031008943749
<hop0>=-0.2181244870091664
<n_d>=0.9999999999999859
<n_d^2>=1.086596899105599
<n_d_ud>=0.04329844955280603
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/43 (scale 1.3524837470954124e-05) ***** 
[1] xi(21)=1.352483747410709e-05 xi_scaled(21)=1.000000000233124 zeta(22)=0
Stats: nr=26 min=1 max=66
Safeguard: keep additional 2 states
Emax=9.033019291674718 nrkept=150 nrkeptmult=344 
Total energy=-3.322539583511904  Egs=-1.121259999274039
Kept: 150 out of 552, ratio=0.272
<flm>=0.913016359373792
<hop0>=-0.2183547953106676
<n_d>=0.9999999999999861
<n_d^2>=1.086983640626183
<n_d_ud>=0.04349182031309777
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 23/43 (scale 7.8085685546013012e-06) ***** 
[1] xi(22)=7.80856855520809e-06 xi_scaled(22)=1.000000000077708 zeta(23)=0
Stats: nr=27 min=1 max=81
Safeguard: keep additional 3 states
Emax=9.115369549382853 nrkept=149 nrkeptmult=348 
Total energy=-3.322547369005301  Egs=-0.9970448927026514
Kept: 149 out of 558, ratio=0.267
<flm>=0.9126752486219022
<hop0>=-0.2185572019828566
<n_d>=0.9999999999999869
<n_d^2>=1.087324751378073
<n_d_ud>=0.04366237568904269
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/43 (scale 4.5082791569847079e-06) ***** 
[1] xi(23)=4.508279157101485e-06 xi_scaled(23)=1.000000000025903 zeta(24)=0
Stats: nr=26 min=1 max=67
Emax=9.074035293274616 nrkept=145 nrkeptmult=337 
Total energy=-3.322553117597841  Egs=-1.275119028866531
Kept: 145 out of 556, ratio=0.261
<flm>=0.912389749403601
<hop0>=-0.2187264029817333
<n_d>=0.9999999999999867
<n_d^2>=1.087610250596374
<n_d_ud>=0.04380512529819323
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 25/43 (scale 2.6028561848671004e-06) ***** 
[1] xi(24)=2.602856184889574e-06 xi_scaled(24)=1.000000000008634 zeta(25)=0
Stats: nr=27 min=1 max=78
Safeguard: keep additional 3 states
Emax=9.109735416265041 nrkept=146 nrkeptmult=336 
Total energy=-3.322555330407172  Egs=-0.8501465978546113
Kept: 146 out of 541, ratio=0.27
<flm>=0.9121476865262951
<hop0>=-0.2188697845195123
<n_d>=0.9999999999999856
<n_d^2>=1.087852313473677
<n_d_ud>=0.04392615673684555
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/43 (scale 1.5027597189949027e-06) ***** 
[1] xi(25)=1.502759718999228e-06 xi_scaled(25)=1.000000000002878 zeta(26)=0
Stats: nr=25 min=1 max=66
Safeguard: keep additional 2 states
Emax=9.007515289558562 nrkept=130 nrkeptmult=284 
Total energy=-3.322557513006831  Egs=-1.452394306440284
Kept: 130 out of 544, ratio=0.239
<flm>=0.9119622335502635
<hop0>=-0.2189796139787542
<n_d>=0.9999999999999868
<n_d^2>=1.088037766449711
<n_d_ud>=0.04401888322486191
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 27/43 (scale 8.676187282890334e-07) ***** 
[1] xi(26)=8.676187282898658e-07 xi_scaled(26)=1.000000000000959 zeta(27)=0
Stats: nr=21 min=1 max=73
Safeguard: keep additional 1 states
Emax=9.058776302284292 nrkept=131 nrkeptmult=300 
Total energy=-3.322558149466891  Egs=-0.7335711397521228
Kept: 131 out of 483, ratio=0.271
<flm>=0.9118308061658208
<hop0>=-0.2190574419518634
<n_d>=0.9999999999999862
<n_d^2>=1.088169193834154
<n_d_ud>=0.04408459691708334
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/43 (scale 5.009199063316343e-07) ***** 
[1] xi(27)=5.009199063317944e-07 xi_scaled(27)=1.00000000000032 zeta(28)=0
Stats: nr=25 min=1 max=62
Emax=9.015427356610465 nrkept=112 nrkeptmult=236 
Total energy=-3.322558948864733  Egs=-1.595859602870649
Kept: 112 out of 490, ratio=0.229
<flm>=0.9117528553595599
<hop0>=-0.2191036010781368
<n_d>=0.9999999999999867
<n_d^2>=1.088247144640416
<n_d_ud>=0.04412357232021389
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 29/43 (scale 2.8920624276301115e-07) ***** 
[1] xi(28)=2.89206242763042e-07 xi_scaled(28)=1.000000000000107 zeta(29)=0
Stats: nr=21 min=1 max=65
Emax=9.08374503462921 nrkept=115 nrkeptmult=254 
Total energy=-3.322559142602431  Egs=-0.669894589636625
Kept: 115 out of 414, ratio=0.278
<flm>=0.9117131666886966
<hop0>=-0.2191271026857007
<n_d>=0.9999999999999868
<n_d^2>=1.088286833311278
<n_d_ud>=0.04414341665564533
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/43 (scale 1.6697330211054477e-07) ***** 
[1] xi(29)=1.669733021105507e-07 xi_scaled(29)=1.000000000000035 zeta(30)=0
Stats: nr=25 min=1 max=55
Safeguard: keep additional 2 states
Emax=9.036884315285361 nrkept=98 nrkeptmult=200 
Total energy=-3.322559421920197  Egs=-1.672828904300784
Kept: 98 out of 428, ratio=0.229
<flm>=0.9116965989257602
<hop0>=-0.2191369132178032
<n_d>=0.999999999999986
<n_d^2>=1.088303401074214
<n_d_ud>=0.04415170053711349
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 31/43 (scale 9.6402080921003717e-08) ***** 
[1] xi(30)=9.640208092100485e-08 xi_scaled(30)=1.000000000000012 zeta(31)=0
Stats: nr=21 min=1 max=57
Emax=9.605572287568711 nrkept=112 nrkeptmult=244 
Total energy=-3.322559483938898  Egs=-0.6433336419300484
Kept: 112 out of 359, ratio=0.312
<flm>=0.9116902809033983
<hop0>=-0.2191406543999795
<n_d>=0.9999999999999866
<n_d^2>=1.088309719096576
<n_d_ud>=0.04415485954829437
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/43 (scale 5.5657767370181585e-08) ***** 
[1] xi(31)=5.56577673701818e-08 xi_scaled(31)=1.000000000000004 zeta(32)=0
Stats: nr=25 min=1 max=54
Emax=9.017666210937007 nrkept=87 nrkeptmult=181 
Total energy=-3.322559578783811  Egs=-1.704073249172231
Kept: 87 out of 416, ratio=0.209
<flm>=0.9116881102706254
<hop0>=-0.2191419397271263
<n_d>=0.9999999999999877
<n_d^2>=1.088311889729351
<n_d_ud>=0.04415594486468132
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/43 (scale 3.213402697366791e-08) ***** 
[1] xi(32)=3.213402697366795e-08 xi_scaled(32)=1.000000000000001 zeta(33)=0
Stats: nr=21 min=1 max=52
Emax=10.06820067950866 nrkept=112 nrkeptmult=244 
Total energy=-3.322559599146006  Egs=-0.6336646083406605
Kept: 112 out of 322, ratio=0.348
<flm>=0.9116873595836182
<hop0>=-0.219142384241812
<n_d>=0.9999999999999886
<n_d^2>=1.08831264041636
<n_d_ud>=0.04415632020818542
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 34/43 (scale 1.8552589123393859e-08) ***** 
[1] xi(33)=1.855258912339387e-08 xi_scaled(33)=1 zeta(34)=0
Stats: nr=25 min=1 max=54
Emax=9.134614721914449 nrkept=87 nrkeptmult=181 
Total energy=-3.32255963096841  Egs=-1.715254054899929
Kept: 87 out of 416, ratio=0.209
<flm>=0.9116871136177569
<hop0>=-0.2191425298889606
<n_d>=0.9999999999999881
<n_d^2>=1.088312886382221
<n_d_ud>=0.04415644319111592
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 35/43 (scale 1.0711342324555969e-08) ***** 
[1] xi(34)=1.071134232455597e-08 xi_scaled(34)=1 zeta(35)=0
Stats: nr=21 min=1 max=52
Emax=10.21461391062467 nrkept=112 nrkeptmult=244 
Total energy=-3.322559637720177  Egs=-0.6303381087712878
Kept: 112 out of 322, ratio=0.348
<flm>=0.9116870292598188
<hop0>=-0.2191425798409873
<n_d>=0.9999999999999885
<n_d^2>=1.08831297074016
<n_d_ud>=0.04415648537008517
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 36/43 (scale 6.1841963744646209e-09) ***** 
[1] xi(35)=6.18419637446462e-09 xi_scaled(35)=0.9999999999999999 zeta(36)=0
Stats: nr=25 min=1 max=54
Emax=9.174836529696906 nrkept=87 nrkeptmult=181 
Total energy=-3.322559648351258  Egs=-1.719072311519192
Kept: 87 out of 416, ratio=0.209
<flm>=0.9116870019538704
<hop0>=-0.2191425960100332
<n_d>=0.9999999999999879
<n_d^2>=1.088312998046107
<n_d_ud>=0.04415649902305907
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 37/43 (scale 3.5704474415186564e-09) ***** 
[1] xi(36)=3.570447441518656e-09 xi_scaled(36)=0.9999999999999999 zeta(37)=0
Stats: nr=21 min=1 max=52
Emax=10.26053377196775 nrkept=112 nrkeptmult=244 
Total energy=-3.322559650597845  Egs=-0.629217191899852
Kept: 112 out of 322, ratio=0.348
<flm>=0.9116869925521727
<hop0>=-0.2191426015771895
<n_d>=0.9999999999999876
<n_d^2>=1.088313007447804
<n_d_ud>=0.04415650372390782
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 38/43 (scale 2.0613987914882068e-09) ***** 
[1] xi(37)=2.061398791488207e-09 xi_scaled(37)=1 zeta(38)=0
Stats: nr=25 min=1 max=54
Emax=9.188379639582049 nrkept=87 nrkeptmult=181 
Total energy=-3.322559654144184  Egs=-1.7203554350379
Kept: 87 out of 416, ratio=0.209
<flm>=0.9116869895178539
<hop0>=-0.2191426033739421
<n_d>=0.9999999999999868
<n_d^2>=1.088313010482122
<n_d_ud>=0.04415650524106699
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 39/43 (scale 1.1901491471728853e-09) ***** 
[1] xi(38)=1.190149147172885e-09 xi_scaled(38)=1 zeta(39)=0
Stats: nr=21 min=1 max=52
Emax=10.27576159897828 nrkept=112 nrkeptmult=244 
Total energy=-3.3225596548926  Egs=-0.6288421954468654
Kept: 112 out of 322, ratio=0.348
<flm>=0.911686988471517
<hop0>=-0.2191426039935241
<n_d>=0.9999999999999871
<n_d^2>=1.088313011528459
<n_d_ud>=0.04415650576423553
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 40/43 (scale 6.8713293049606891e-10) ***** 
[1] xi(39)=6.871329304960689e-10 xi_scaled(39)=1 zeta(40)=0
Stats: nr=25 min=1 max=54
Emax=9.192908587125904 nrkept=87 nrkeptmult=181 
Total energy=-3.322559656075007  Egs=-1.720784295485392
Kept: 87 out of 416, ratio=0.209
<flm>=0.9116869881341648
<hop0>=-0.2191426041932846
<n_d>=0.9999999999999865
<n_d^2>=1.08831301186581
<n_d_ud>=0.0441565059329113
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 41/43 (scale 3.9671638239096179e-10) ***** 
[1] xi(40)=3.967163823909618e-10 xi_scaled(40)=1 zeta(41)=0
Stats: nr=21 min=1 max=52
Emax=10.28083464309538 nrkept=112 nrkeptmult=244 
Total energy=-3.32255965632443  Egs=-0.6287170481589298
Kept: 112 out of 322, ratio=0.348
<flm>=0.9116869880177804
<hop0>=-0.2191426042622014
<n_d>=0.9999999999999869
<n_d^2>=1.088313011982196
<n_d_ud>=0.0441565059911039
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 42/43 (scale 2.2904431016535628e-10) ***** 
[1] xi(41)=2.290443101653563e-10 xi_scaled(41)=1 zeta(42)=0
Stats: nr=25 min=1 max=54
Emax=9.194419797111602 nrkept=87 nrkeptmult=181 
Total energy=-3.322559656718598  Egs=-1.720927374315099
Kept: 87 out of 416, ratio=0.209
<flm>=0.9116869879802695
<hop0>=-0.219142604284413
<n_d>=0.9999999999999869
<n_d^2>=1.088313012019706
<n_d_ud>=0.0441565060098592
Memory used: 65 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 43/43 (scale 1.3223879413032059e-10) ***** 
[1] xi(42)=1.322387941303206e-10 xi_scaled(42)=1 zeta(43)=0
Stats: nr=21 min=1 max=52
Emax=10.28252547088984 nrkept=112 nrkeptmult=244 
Total energy=-3.322559656801733  Egs=-0.6286753169658829
Kept: 112 out of 322, ratio=0.348
<flm>=0.9116869879673266
<hop0>=-0.2191426042920772
<n_d>=0.9999999999999871
<n_d^2>=1.088313012032649
<n_d_ud>=0.04415650601633069
Memory used: 65 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -3.322559656801733
TKW=1.199315142921574e-06

Memory usage report
===================
  after diag: 67360 kB
after recalc: 67360 kB
 after split: 67360 kB
  after trim: 67360 kB
 after trunc: 67360 kB
      diag_h: 67360 kB

Peak usage: 67360 kB

Timing report
=============
         All: 0 s
        diag: 0 s
    recalc f: 0 s
    recalc s: 0 s
       Other: 0 s