NRG Ljubljana 2.3.20 - (c) Rok Zitko <rok.zitko@ijs.si>
$Id: nrg.cc,v 1.31 2012/10/26 10:18:22 rokzitko Exp rokzitko $
Timestamp: Fri May 31 11:54:49 2013
Compiled on Jun  5 2013 at 18:59:39

No MPI: single node calculation.

workdir=.
Tmin=1e-10 -> Nmax=33
TEMPERATURE T=1.78139792976e-10
Nmax=33
Tmin=1e-10
Ninit=0
Lambda=4
strategy=kept
lastall=0
lastalloverride=0
z=0.75
discretization=Z
band=flat
betabar=1
T=1.78139792976e-10
T_ratio=1
Tmin_ratio=-999
keep=5000
keepenergy=10
keepmin=0
keepblock=0
keepzrescale=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
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
saveall=0
dumpannotated=0
dumpscaled=1
dumpabs=0
dumpprecision=8
dumpgroups=1
grouptol=1e-06
dumpdiagonal=0
ops=
specs=
specd=
spect=
specb=
reim=0
trsq=
specgt=
gtp=0.7
speci1t=
speci2t=
speckubo=
kubop=0.7
kubor=4
kubob=2
cond=
specchit=
chitp=1
chitp_ratio=-999
dm=0
T0opt=-1
dmnrg=0
cfs=0
fdm=0
fdmexpv=0
fdmexpvn=0
mats=0
nromegan=100
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
restart=1
restartfactor=2
checkdiag=0
checkrho=0
calc0=1
tdht=0
spin=2
tri=old
preccpp=2000
checksumrules=0
showEs=0
globalB=0
globalBx=0
polarized=0
pol2x2=0
mpi=0
saveF=0
trunc=
noimag=1
dumpsubspaces=0
done=0
resume=0
forcestop=-1
stopafter=
removefiles=1
store=one

>>  Input file for NRG Ljubljana, Rok Zitko, rok.zitko@ijs.si, 2005-2012
SYMMETRY TYPE: QS
>>  $Id: initial.m,v 1.1 2012/05/15 09:58:19 rokzitko Exp rokzitko $
>>  Using sneg version 	1.233
>>  Model: 	SIAM	 Variant: 		 Channels: 	1
>>  U=	0.01	 Gamma=	0.0006	 Delta=	0.002	 t=	0.
>> 
>>  Gamma^(1/2)=	0.019544100476116797
>>  Lambda=	4.	 BAND=	flat
>>  DISCRETIZATION=	Z	 z=	0.75
>>  ops=	
V7
>>  Number of channels, impurities, subspaces: 
channels=1 impurities=1 subspaces=6
Reading <||||> (e)
Reading <||||> (z)

# $Id: nrg.cc,v 1.31 2012/10/26 10:18:22 rokzitko Exp rokzitko $ QS
# disk=Z band=flat Lambda=4 z=0.75
# keep=5000 keepenergy=10 Nmax=33 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.0259526495822 
(-1 2) 2 states
0.0121626537437 0.0377821291338 
(0 1) 3 states
0 0.0272511287735 0.0512603254021 
(0 3) 1 states
0.0239921332953 
(1 2) 2 states
0.0133040382065 0.0392547663869 
(2 1) 1 states
0.0285666712981 
Number of states (multiplicity taken into account): 16

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

Computing the following spectra:

Before NRG iteration (N=-1)

 ***** [NRG] Iteration 1/33 (scale 0.76510458494759226) ***** 
[1] xi(0)=0.76384659685 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=3.06622616013 nrkept=35 nrkeptmult=64 
Total energy=-1.16749294509  Egs=-1.48055571094
Kept: 35 out of 35, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/33 (scale 0.38255229247379613) ***** 
[1] xi(1)=1.03835796029 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=7.50667787611 nrkept=126 nrkeptmult=256 
Total energy=-1.43132791246  Egs=-0.689670334127
Kept: 126 out of 126, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/33 (scale 0.19127614623689806) ***** 
[1] xi(2)=1.0510904621 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Safeguard: keep additional 4 states
Emax=10.0693934963 nrkept=267 nrkeptmult=601 
Total energy=-1.75953990786  Egs=-1.71590656681
Kept: 267 out of 462, ratio=0.578
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/33 (scale 0.095638073118449032) ***** 
[1] xi(3)=1.00917127924 zeta(4)=0
Stats: nr=28 min=1 max=118 sum3=6688082
Emax=11.4637915268 nrkept=261 nrkeptmult=580 
Total energy=-1.8197438875  Egs=-0.629498040656
Kept: 261 out of 992, ratio=0.263
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/33 (scale 0.047819036559224516) ***** 
[1] xi(4)=1.00135573228 zeta(5)=0
Stats: nr=29 min=1 max=139 sum3=7105402
Emax=10.6106499695 nrkept=263 nrkeptmult=589 
Total energy=-1.89685007799  Egs=-1.61245805096
Kept: 263 out of 970, ratio=0.271
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/33 (scale 0.023909518279612258) ***** 
[1] xi(5)=1.00028520546 zeta(6)=0
Stats: nr=28 min=1 max=116 sum3=6391852
Emax=10.0055635717 nrkept=157 nrkeptmult=323 
Total energy=-1.91307306554  Egs=-0.678515867898
Kept: 157 out of 976, ratio=0.161
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/33 (scale 0.011954759139806129) ***** 
[1] xi(6)=1.00006871662 zeta(7)=0
Stats: nr=21 min=1 max=93 sum3=1945688
Emax=10.0104350056 nrkept=227 nrkeptmult=513 
Total energy=-1.93123610071  Egs=-1.51931418817
Kept: 227 out of 578, ratio=0.393
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/33 (scale 0.0059773795699030645) ***** 
[1] xi(7)=1.00001703192 zeta(8)=0
Stats: nr=26 min=1 max=105 sum3=4575731
Emax=10.06998774 nrkept=157 nrkeptmult=323 
Total energy=-1.93562549268  Egs=-0.734333818759
Kept: 157 out of 851, ratio=0.184
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/33 (scale 0.0029886897849515323) ***** 
[1] xi(8)=1.00000424897 zeta(9)=0
Stats: nr=21 min=1 max=93 sum3=1945688
Emax=10.0194181021 nrkept=198 nrkeptmult=446 
Total energy=-1.93988917404  Egs=-1.42660552434
Kept: 198 out of 578, ratio=0.343
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/33 (scale 0.0014943448924757661) ***** 
[1] xi(9)=1.00000106168 zeta(10)=0
Stats: nr=26 min=1 max=93 sum3=3106981
Emax=10.0167231127 nrkept=135 nrkeptmult=281 
Total energy=-1.94106132064  Egs=-0.784388266707
Kept: 135 out of 739, ratio=0.183
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/33 (scale 0.00074717244623788307) ***** 
[1] xi(10)=1.00000026539 zeta(11)=0
Stats: nr=21 min=1 max=80 sum3=1234103
Emax=10.019698711 nrkept=139 nrkeptmult=319 
Total energy=-1.94205913972  Egs=-1.33546022287
Kept: 139 out of 497, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/33 (scale 0.00037358622311894153) ***** 
[1] xi(11)=1.00000006634 zeta(12)=0
Stats: nr=25 min=1 max=69 sum3=1135102
Emax=10.0062810289 nrkept=100 nrkeptmult=217 
Total energy=-1.94237646262  Egs=-0.849396687696
Kept: 100 out of 520, ratio=0.192
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/33 (scale 0.00018679311155947077) ***** 
[1] xi(12)=1.00000001659 zeta(13)=0
Stats: nr=20 min=1 max=59 sum3=504419
Emax=10.005110366 nrkept=116 nrkeptmult=274 
Total energy=-1.94260459255  Egs=-1.22129733854
Kept: 116 out of 371, ratio=0.313
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 14/33 (scale 9.3396555779735383e-05) ***** 
[1] xi(13)=1.00000000415 zeta(14)=0
Stats: nr=25 min=1 max=55 sum3=686784
Emax=10.1495788618 nrkept=90 nrkeptmult=197 
Total energy=-1.94269378856  Egs=-0.955024600567
Kept: 90 out of 438, ratio=0.205
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 15/33 (scale 4.6698277889867692e-05) ***** 
[1] xi(14)=1.00000000104 zeta(15)=0
Stats: nr=20 min=1 max=54 sum3=373637
Emax=10.0249100825 nrkept=112 nrkeptmult=264 
Total energy=-1.94274339705  Egs=-1.0623195901
Kept: 112 out of 335, ratio=0.334
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 16/33 (scale 2.3349138944933846e-05) ***** 
[1] xi(15)=1.00000000026 zeta(16)=0
Stats: nr=24 min=1 max=54 sum3=628466
Emax=10.0074660729 nrkept=88 nrkeptmult=195 
Total energy=-1.94276969791  Egs=-1.12641661355
Kept: 88 out of 422, ratio=0.209
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 17/33 (scale 1.1674569472466923e-05) ***** 
[1] xi(16)=1.00000000006 zeta(17)=0
Stats: nr=20 min=1 max=53 sum3=353387
Emax=10.0247764302 nrkept=104 nrkeptmult=238 
Total energy=-1.94277973418  Egs=-0.859669000935
Kept: 104 out of 329, ratio=0.316
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/33 (scale 5.8372847362334614e-06) ***** 
[1] xi(17)=1.00000000002 zeta(18)=0
Stats: nr=24 min=1 max=51 sum3=512160
Emax=10.107420422 nrkept=84 nrkeptmult=181 
Total energy=-1.94278774817  Egs=-1.37289754287
Kept: 84 out of 390, ratio=0.215
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 19/33 (scale 2.9186423681167307e-06) ***** 
[1] xi(18)=1 zeta(19)=0
Stats: nr=20 min=1 max=50 sum3=299904
Emax=10.0561173966 nrkept=93 nrkeptmult=209 
Total energy=-1.94278972037  Egs=-0.675725493513
Kept: 93 out of 312, ratio=0.298
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/33 (scale 1.4593211840583654e-06) ***** 
[1] xi(19)=1 zeta(20)=0
Stats: nr=23 min=1 max=47 sum3=381364
Emax=10.092226068 nrkept=79 nrkeptmult=167 
Total energy=-1.94279206983  Egs=-1.60996784667
Kept: 79 out of 346, ratio=0.228
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 21/33 (scale 7.2966059202918268e-07) ***** 
[1] xi(20)=1 zeta(21)=0
Stats: nr=20 min=1 max=47 sum3=246838
Emax=10.0046049252 nrkept=78 nrkeptmult=171 
Total energy=-1.94279250349  Egs=-0.594332494849
Kept: 78 out of 292, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/33 (scale 3.6483029601459134e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=23 min=1 max=40 sum3=238699
Emax=10.0177195916 nrkept=75 nrkeptmult=157 
Total energy=-1.94279312416  Egs=-1.70125012349
Kept: 75 out of 289, ratio=0.26
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 23/33 (scale 1.8241514800729567e-07) ***** 
[1] xi(22)=1 zeta(23)=0
Stats: nr=20 min=1 max=43 sum3=199079
Emax=10.0234475312 nrkept=68 nrkeptmult=140 
Total energy=-1.94279323066  Egs=-0.583836414374
Kept: 68 out of 275, ratio=0.247
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/33 (scale 9.1207574003647835e-08) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=21 min=1 max=37 sum3=178372
Emax=10.0017628699 nrkept=71 nrkeptmult=145 
Total energy=-1.94279338535  Egs=-1.69604268123
Kept: 71 out of 250, ratio=0.284
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 25/33 (scale 4.5603787001823918e-08) ***** 
[1] xi(24)=1 zeta(25)=0
Stats: nr=20 min=1 max=41 sum3=170311
Emax=10.0215468043 nrkept=58 nrkeptmult=115 
Total energy=-1.94279341184  Egs=-0.580779352988
Kept: 58 out of 259, ratio=0.224
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/33 (scale 2.2801893500911959e-08) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=18 min=1 max=34 sum3=119096
Emax=10.0103040412 nrkept=70 nrkeptmult=144 
Total energy=-1.94279345048  Egs=-1.69464518797
Kept: 70 out of 212, ratio=0.33
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 27/33 (scale 1.1400946750455979e-08) ***** 
[1] xi(26)=1 zeta(27)=0
Stats: nr=20 min=1 max=41 sum3=166486
Emax=10.163722675 nrkept=58 nrkeptmult=115 
Total energy=-1.94279345709  Egs=-0.579980661407
Kept: 58 out of 256, ratio=0.227
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/33 (scale 5.7004733752279897e-09) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=18 min=1 max=34 sum3=119096
Emax=10.021498907 nrkept=70 nrkeptmult=144 
Total energy=-1.94279346675  Egs=-1.69428913753
Kept: 70 out of 212, ratio=0.33
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 29/33 (scale 2.8502366876139948e-09) ***** 
[1] xi(28)=1 zeta(29)=0
Stats: nr=20 min=1 max=41 sum3=166486
Emax=10.2014511982 nrkept=58 nrkeptmult=115 
Total energy=-1.9427934684  Egs=-0.579778675182
Kept: 58 out of 256, ratio=0.227
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/33 (scale 1.4251183438069974e-09) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=18 min=1 max=34 sum3=119096
Emax=10.0243073971 nrkept=70 nrkeptmult=144 
Total energy=-1.94279347082  Egs=-1.69419969419
Kept: 70 out of 212, ratio=0.33
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 31/33 (scale 7.1255917190349871e-10) ***** 
[1] xi(30)=1 zeta(31)=0
Stats: nr=20 min=1 max=41 sum3=166486
Emax=10.2110186154 nrkept=58 nrkeptmult=115 
Total energy=-1.94279347123  Egs=-0.579728031756
Kept: 58 out of 256, ratio=0.227
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/33 (scale 3.5627958595174936e-10) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=18 min=1 max=34 sum3=119096
Emax=10.0250101251 nrkept=70 nrkeptmult=144 
Total energy=-1.94279347183  Egs=-1.69417730541
Kept: 70 out of 212, ratio=0.33
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/33 (scale 1.7813979297587468e-10) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=20 min=1 max=41 sum3=166486
Emax=10.2134188798 nrkept=58 nrkeptmult=115 
Total energy=-1.94279347194  Egs=-0.579715362156
Kept: 58 out of 256, ratio=0.227
Memory used: 7 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:              -1.94279347193821
TKW=3.44475771533e-06
Grand canonical Z=              6.419209864338442
Zft (last shell)=               6.417606636472333

Memory usage report
===================
  after diag: 7768 kB
after recalc: 7780 kB
 after split: 7776 kB
  after trim: 7780 kB
 after trunc: 7768 kB
      diag_h: 7768 kB

Peak usage: 7780 kB

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