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=	0.0047	 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
0.0243206204804 
(-1 2) 2 states
0.0114500427343 0.0369951465978 
(0 1) 3 states
0 0.0273455383346 0.0515632225103 
(0 3) 1 states
0.0241245688517 
(1 2) 2 states
0.0141345028462 0.0404536375184 
(2 1) 1 states
0.0304635715128 
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=3.06975130132 nrkept=35 nrkeptmult=64 
Total energy=-1.16479297875  Egs=-1.48029088383
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=7.50883366711 nrkept=126 nrkeptmult=256 
Total energy=-1.42895177427  Egs=-0.69051682793
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=10.0693372096 nrkept=264 nrkeptmult=592 
Total energy=-1.75684041832  Egs=-1.7142160719
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=6408134
Safeguard: keep additional 2 states
Emax=11.4638564104 nrkept=263 nrkeptmult=584 
Total energy=-1.81755099551  Egs=-0.634795068637
Kept: 263 out of 980, ratio=0.268
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=140 sum3=7258926
Emax=10.6101865868 nrkept=263 nrkeptmult=589 
Total energy=-1.89415638545  Egs=-1.60198522284
Kept: 263 out of 978, ratio=0.269
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=6391852
Emax=10.0050894453 nrkept=157 nrkeptmult=323 
Total energy=-1.91102926793  Egs=-0.705697299699
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=10.4036113132 nrkept=245 nrkeptmult=549 
Total energy=-1.92858337999  Egs=-1.46837856391
Kept: 245 out of 578, ratio=0.424
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=27 min=1 max=112 sum3=5439853
Emax=10.0094841827 nrkept=155 nrkeptmult=319 
Total energy=-1.93360376606  Egs=-0.839897485843
Kept: 155 out of 913, ratio=0.17
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=92 sum3=1879393
Emax=10.0280905827 nrkept=191 nrkeptmult=424 
Total energy=-1.93748981548  Egs=-1.3002518485
Kept: 191 out of 571, ratio=0.335
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=92 sum3=2902323
Emax=10.2245617048 nrkept=125 nrkeptmult=261 
Total energy=-1.93897553352  Egs=-0.994227000302
Kept: 125 out of 711, ratio=0.176
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=20 min=1 max=76 sum3=1050491
Emax=10.0469751592 nrkept=145 nrkeptmult=329 
Total energy=-1.93984466651  Egs=-1.16322943701
Kept: 145 out of 461, ratio=0.315
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=24 min=2 max=76 sum3=1339334
Emax=10.091529354 nrkept=106 nrkeptmult=228 
Total energy=-1.94024300642  Egs=-1.06625965598
Kept: 106 out of 542, ratio=0.196
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=63 sum3=627849
Emax=10.0193862427 nrkept=110 nrkeptmult=245 
Total energy=-1.94044639781  Egs=-1.08885912465
Kept: 110 out of 393, ratio=0.28
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=24 min=1 max=59 sum3=612385
Emax=10.065878035 nrkept=83 nrkeptmult=176 
Total energy=-1.94054627105  Egs=-1.06934607037
Kept: 83 out of 409, ratio=0.203
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=49 sum3=298249
Emax=10.1285600944 nrkept=77 nrkeptmult=162 
Total energy=-1.94059584387  Egs=-1.06155574933
Kept: 77 out of 307, ratio=0.251
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=20 min=1 max=46 sum3=250652
Emax=10.052964705 nrkept=68 nrkeptmult=142 
Total energy=-1.94062063856  Egs=-1.06191003736
Kept: 68 out of 284, ratio=0.239
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=41 sum3=167344
Emax=10.0359589465 nrkept=64 nrkeptmult=132 
Total energy=-1.94063294331  Egs=-1.05397951419
Kept: 64 out of 250, ratio=0.256
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=20 min=1 max=38 sum3=135721
Emax=10.0227762209 nrkept=61 nrkeptmult=125 
Total energy=-1.94063912353  Egs=-1.05874885119
Kept: 61 out of 235, ratio=0.26
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=35 sum3=113342
Emax=10.1502467393 nrkept=61 nrkeptmult=125 
Total energy=-1.94064219413  Egs=-1.0520622163
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.1953427175 nrkept=61 nrkeptmult=125 
Total energy=-1.94064373786  Egs=-1.05784466876
Kept: 61 out of 224, ratio=0.272
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=35 sum3=113342
Emax=10.2353614945 nrkept=61 nrkeptmult=125 
Total energy=-1.94064450516  Egs=-1.05158265072
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.2392025881 nrkept=61 nrkeptmult=125 
Total energy=-1.94064489101  Egs=-1.0576106919
Kept: 61 out of 224, ratio=0.272
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=35 sum3=113342
Emax=10.2572509734 nrkept=61 nrkeptmult=125 
Total energy=-1.94064508281  Egs=-1.05146277315
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.2502111311 nrkept=61 nrkeptmult=125 
Total energy=-1.94064517927  Egs=-1.05755168516
Kept: 61 out of 224, ratio=0.272
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=35 sum3=113342
Emax=10.2627630774 nrkept=61 nrkeptmult=125 
Total energy=-1.94064522722  Egs=-1.05143280722
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.2529660838 nrkept=61 nrkeptmult=125 
Total energy=-1.94064525133  Egs=-1.0575368982
Kept: 61 out of 224, ratio=0.272
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=35 sum3=113342
Emax=10.2641436619 nrkept=61 nrkeptmult=125 
Total energy=-1.94064526332  Egs=-1.05142531855
Kept: 61 out of 224, ratio=0.272
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/33 (scale 5.7004733752279897e-09) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.2536550315 nrkept=61 nrkeptmult=125 
Total energy=-1.94064526935  Egs=-1.05753319642
Kept: 61 out of 224, ratio=0.272
Memory used: 8 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=35 sum3=113342
Emax=10.2644889781 nrkept=61 nrkeptmult=125 
Total energy=-1.94064527234  Egs=-1.05142344927
Kept: 61 out of 224, ratio=0.272
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/33 (scale 1.4251183438069974e-09) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.2538272936 nrkept=61 nrkeptmult=125 
Total energy=-1.94064527385  Egs=-1.05753226788
Kept: 61 out of 224, ratio=0.272
Memory used: 8 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=35 sum3=113342
Emax=10.2645753165 nrkept=61 nrkeptmult=125 
Total energy=-1.9406452746  Egs=-1.05142298487
Kept: 61 out of 224, ratio=0.272
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/33 (scale 3.5627958595174936e-10) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.2538703673 nrkept=61 nrkeptmult=125 
Total energy=-1.94064527498  Egs=-1.05753203279
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.2645968978 nrkept=61 nrkeptmult=125 
Total energy=-1.94064527516  Egs=-1.0514228717
Kept: 61 out of 224, ratio=0.272
Memory used: 8 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -1.940645275163549
TKW=0.000244662260322
Grand canonical Z=              4.911390274835787
Zft (last shell)=               4.910384446407146

Memory usage report
===================
  after diag: 8236 kB
after recalc: 8248 kB
 after split: 8240 kB
  after trim: 8248 kB
 after trunc: 8236 kB
      diag_h: 8236 kB

Peak usage: 8248 kB

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