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=	0.00222817	 Delta=	0	 t=	0.
>> 
>>  Gamma^(1/2)=	0.03766294038171042
>>  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
0.050886739723 
(-1 2) 2 states
0.0245858765546 0.0739200757466 
(0 1) 3 states
0 0.050886739723 0.0985059523012 
(0 3) 1 states
0.0476192125781 
(1 2) 2 states
0.0245858765546 0.0739200757466 
(2 1) 1 states
0.050886739723 
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=3.06820606978 nrkept=35 nrkeptmult=64 
Total energy=-1.17124926578  Egs=-1.43559708259
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=7.61739869289 nrkept=126 nrkeptmult=256 
Total energy=-1.45452666633  Egs=-0.740493276663
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 1 states
Emax=10.0914330965 nrkept=264 nrkeptmult=594 
Total energy=-1.7646165879  Egs=-1.62116357774
Kept: 264 out of 462, ratio=0.571
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=116 sum3=6400760
Safeguard: keep additional 1 states
Emax=11.484346725 nrkept=262 nrkeptmult=584 
Total energy=-1.83403813855  Egs=-0.725877763854
Kept: 262 out of 980, ratio=0.267
Memory used: 5 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=7145444
Safeguard: keep additional 1 states
Emax=10.7060597976 nrkept=264 nrkeptmult=594 
Total energy=-1.90311418754  Egs=-1.44453033686
Kept: 264 out of 974, ratio=0.271
Memory used: 6 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=6400760
Emax=10.0669585507 nrkept=157 nrkeptmult=323 
Total energy=-1.92338723105  Egs=-0.847906815614
Kept: 157 out of 980, ratio=0.16
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=94 sum3=1975880
Emax=10.0337381657 nrkept=201 nrkeptmult=446 
Total energy=-1.93831555758  Egs=-1.24873503207
Kept: 201 out of 578, ratio=0.348
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=94 sum3=3271438
Emax=10.3078557314 nrkept=156 nrkeptmult=320 
Total energy=-1.94433771961  Egs=-1.00749198847
Kept: 156 out of 748, ratio=0.209
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=1927024
Safeguard: keep additional 2 states
Emax=10.0711307523 nrkept=178 nrkeptmult=402 
Total energy=-1.94740102048  Egs=-1.02496447801
Kept: 178 out of 574, ratio=0.31
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=25 min=1 max=83 sum3=2321272
Safeguard: keep additional 2 states
Emax=10.0489861469 nrkept=125 nrkeptmult=265 
Total energy=-1.94920839657  Egs=-1.20947720919
Kept: 125 out of 664, ratio=0.188
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=72 sum3=926178
Safeguard: keep additional 2 states
Emax=10.008065811 nrkept=128 nrkeptmult=288 
Total energy=-1.9498048166  Egs=-0.798236115167
Kept: 128 out of 462, ratio=0.277
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=61 sum3=918520
Safeguard: keep additional 1 states
Emax=10.0028044761 nrkept=92 nrkeptmult=188 
Total energy=-1.9503515381  Egs=-1.46344127129
Kept: 92 out of 478, 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=21 min=1 max=55 sum3=390464
Safeguard: keep additional 3 states
Emax=10.0032575176 nrkept=94 nrkeptmult=210 
Total energy=-1.95047002844  Egs=-0.634340027545
Kept: 94 out of 338, ratio=0.278
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=23 min=1 max=46 sum3=383576
Safeguard: keep additional 3 states
Emax=10.2321681774 nrkept=83 nrkeptmult=173 
Total energy=-1.95062545071  Egs=-1.66411128634
Kept: 83 out of 350, ratio=0.237
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=21 min=1 max=48 sum3=267870
Emax=10.2277556488 nrkept=72 nrkeptmult=148 
Total energy=-1.95065174005  Egs=-0.562961669034
Kept: 72 out of 306, ratio=0.235
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.181799477 nrkept=76 nrkeptmult=158 
Total energy=-1.95069258898  Egs=-1.74948346859
Kept: 76 out of 264, ratio=0.288
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=21 min=1 max=43 sum3=198842
Emax=11.3995331103 nrkept=72 nrkeptmult=148 
Total energy=-1.95069890464  Egs=-0.540975819176
Kept: 72 out of 278, ratio=0.259
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.4141689037 nrkept=74 nrkeptmult=154 
Total energy=-1.95070926443  Egs=-1.77476135275
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.8147979372 nrkept=72 nrkeptmult=148 
Total energy=-1.95071082625  Egs=-0.535119642979
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5342147226 nrkept=74 nrkeptmult=154 
Total energy=-1.95071342585  Egs=-1.78137334157
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9279883432 nrkept=72 nrkeptmult=148 
Total energy=-1.95071381522  Egs=-0.533630475812
Kept: 72 out of 270, 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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5652098113 nrkept=74 nrkeptmult=154 
Total energy=-1.95071446572  Egs=-1.78304547259
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9568779143 nrkept=72 nrkeptmult=148 
Total energy=-1.950714563  Egs=-0.533256564207
Kept: 72 out of 270, ratio=0.267
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=196806
Safeguard: keep additional 1 states
Emax=10.5730201475 nrkept=74 nrkeptmult=154 
Total energy=-1.95071472566  Egs=-1.78346471485
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9641371937 nrkept=72 nrkeptmult=148 
Total energy=-1.95071474998  Egs=-0.533162984288
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.574976577 nrkept=74 nrkeptmult=154 
Total energy=-1.95071479065  Egs=-1.78356960116
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9659543154 nrkept=72 nrkeptmult=148 
Total energy=-1.95071479673  Egs=-0.533139582929
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5754659245 nrkept=74 nrkeptmult=154 
Total energy=-1.95071480689  Egs=-1.78359582746
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Safeguard: keep additional 5 states
Emax=11.9664210985 nrkept=77 nrkeptmult=164 
Total energy=-1.95071480841  Egs=-0.533133732194
Kept: 77 out of 270, ratio=0.285
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=23 min=1 max=39 sum3=226022
Safeguard: keep additional 1 states
Emax=10.5755823278 nrkept=74 nrkeptmult=154 
Total energy=-1.95071481095  Egs=-1.78360238433
Kept: 74 out of 284, ratio=0.261
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=21 min=1 max=41 sum3=176130
Safeguard: keep additional 10 states
Emax=11.9665367334 nrkept=82 nrkeptmult=182 
Total energy=-1.95071481133  Egs=-0.533132269487
Kept: 82 out of 270, ratio=0.304
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=23 min=1 max=40 sum3=253576
Safeguard: keep additional 1 states
Emax=10.5756055666 nrkept=74 nrkeptmult=154 
Total energy=-1.95071481197  Egs=-1.78360402357
Kept: 74 out of 304, ratio=0.243
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/33 (scale 1.7813979297587468e-10) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=21 min=1 max=41 sum3=176130
Safeguard: keep additional 15 states
Emax=11.9665616739 nrkept=87 nrkeptmult=192 
Total energy=-1.95071481206  Egs=-0.533131903856
Kept: 87 out of 270, ratio=0.322
Memory used: 8 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -1.950714812064231
TKW=0.00036072457698
Grand canonical Z=              6.708524268818707
Zft (last shell)=               6.708156833985271

Memory usage report
===================
  after diag: 8360 kB
after recalc: 8360 kB
 after split: 8360 kB
  after trim: 8360 kB
 after trunc: 8360 kB
      diag_h: 8360 kB

Peak usage: 8360 kB

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