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=	0.003	 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
0.0253357997425 
(-1 2) 2 states
0.0118934107369 0.03747117789 
(0 1) 3 states
0 0.0272771832296 0.0513442377137 
(0 3) 1 states
0.0240287888845 
(1 2) 2 states
0.0136058790857 0.0396797421152 
(2 1) 1 states
0.0292568323163 
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=3.06753175977 nrkept=35 nrkeptmult=64 
Total energy=-1.16649295439  Egs=-1.48048241193
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=7.507278637 nrkept=126 nrkeptmult=256 
Total energy=-1.43041768652  Egs=-0.689904981147
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=10.0693808528 nrkept=267 nrkeptmult=601 
Total energy=-1.75854004889  Egs=-1.71543796142
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=11.4637947869 nrkept=261 nrkeptmult=580 
Total energy=-1.81888435328  Egs=-0.63096528841
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=10.6104564563 nrkept=263 nrkeptmult=589 
Total energy=-1.89585181164  Egs=-1.60955686063
Kept: 263 out of 970, ratio=0.271
Memory used: 8 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=10.005381065 nrkept=157 nrkeptmult=323 
Total energy=-1.91225025327  Egs=-0.685854120397
Kept: 157 out of 976, ratio=0.161
Memory used: 8 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=10.3285829833 nrkept=245 nrkeptmult=549 
Total energy=-1.93024856156  Egs=-1.50553499957
Kept: 245 out of 578, ratio=0.424
Memory used: 8 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=10.0675702302 nrkept=157 nrkeptmult=323 
Total energy=-1.93479102211  Egs=-0.759941792205
Kept: 157 out of 913, ratio=0.172
Memory used: 8 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=10.0023506388 nrkept=195 nrkeptmult=438 
Total energy=-1.93892738721  Egs=-1.38400617117
Kept: 195 out of 578, ratio=0.337
Memory used: 8 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=3037075
Emax=10.0172723549 nrkept=137 nrkeptmult=284 
Total energy=-1.94018602497  Egs=-0.84226724648
Kept: 137 out of 727, ratio=0.188
Memory used: 8 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=81 sum3=1294140
Emax=10.0263663008 nrkept=145 nrkeptmult=332 
Total energy=-1.94111908371  Egs=-1.24878632815
Kept: 145 out of 504, ratio=0.288
Memory used: 8 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=73 sum3=1283846
Emax=10.0039980227 nrkept=103 nrkeptmult=224 
Total energy=-1.94147378068  Egs=-0.949438033558
Kept: 103 out of 542, ratio=0.19
Memory used: 8 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=60 sum3=542321
Emax=10.0138721433 nrkept=120 nrkeptmult=280 
Total energy=-1.94167609259  Egs=-1.0830801446
Kept: 120 out of 383, ratio=0.313
Memory used: 8 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=763201
Emax=10.0706435759 nrkept=97 nrkeptmult=213 
Total energy=-1.94178043886  Egs=-1.11723902123
Kept: 97 out of 451, ratio=0.215
Memory used: 8 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=58 sum3=470665
Emax=10.1040538484 nrkept=108 nrkeptmult=248 
Total energy=-1.94182145198  Egs=-0.878257694508
Kept: 108 out of 361, ratio=0.299
Memory used: 8 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=53 sum3=565725
Emax=10.0206824507 nrkept=88 nrkeptmult=188 
Total energy=-1.94185324378  Egs=-1.36158340805
Kept: 88 out of 405, ratio=0.217
Memory used: 8 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=353528
Emax=10.0625564688 nrkept=96 nrkeptmult=216 
Total energy=-1.94186129113  Egs=-0.689305433572
Kept: 96 out of 326, ratio=0.294
Memory used: 8 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=49 sum3=408028
Emax=10.0712298153 nrkept=80 nrkeptmult=169 
Total energy=-1.94187065354  Egs=-1.60389776619
Kept: 80 out of 358, ratio=0.223
Memory used: 8 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=48 sum3=261482
Emax=10.0696741773 nrkept=77 nrkeptmult=168 
Total energy=-1.94187256693  Egs=-0.655576542455
Kept: 77 out of 296, ratio=0.26
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/33 (scale 1.4593211840583654e-06) ***** 
[1] xi(19)=1 zeta(20)=0
Stats: nr=22 min=1 max=42 sum3=250792
Emax=10.1345617608 nrkept=75 nrkeptmult=157 
Total energy=-1.94187489604  Egs=-1.59602103314
Kept: 75 out of 286, ratio=0.262
Memory used: 8 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=44 sum3=205218
Emax=10.0530249506 nrkept=62 nrkeptmult=125 
Total energy=-1.94187536615  Egs=-0.644286503861
Kept: 62 out of 276, ratio=0.225
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/33 (scale 3.6483029601459134e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=18 min=1 max=36 sum3=145991
Emax=10.0920569289 nrkept=71 nrkeptmult=145 
Total energy=-1.94187594643  Egs=-1.5905538433
Kept: 71 out of 227, ratio=0.313
Memory used: 8 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=42 sum3=176408
Emax=10.2877393022 nrkept=58 nrkeptmult=115 
Total energy=-1.94187606335  Egs=-0.640975972965
Kept: 58 out of 260, ratio=0.223
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/33 (scale 9.1207574003647835e-08) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=18 min=1 max=34 sum3=119096
Emax=10.0270503275 nrkept=70 nrkeptmult=144 
Total energy=-1.94187620829  Egs=-1.58906878777
Kept: 70 out of 212, ratio=0.33
Memory used: 8 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=166697
Emax=10.4562855235 nrkept=58 nrkeptmult=115 
Total energy=-1.94187623748  Egs=-0.640108929816
Kept: 58 out of 257, ratio=0.226
Memory used: 8 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=10.0435826807 nrkept=70 nrkeptmult=144 
Total energy=-1.94187627371  Egs=-1.58868917319
Kept: 70 out of 212, ratio=0.33
Memory used: 8 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=166697
Emax=10.5001186513 nrkept=58 nrkeptmult=115 
Total energy=-1.941876281  Egs=-0.639889495619
Kept: 58 out of 257, ratio=0.226
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=18 min=1 max=34 sum3=119096
Emax=10.0477005704 nrkept=70 nrkeptmult=144 
Total energy=-1.94187629006  Egs=-1.5885937469
Kept: 70 out of 212, ratio=0.33
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=41 sum3=166697
Emax=10.5111767951 nrkept=58 nrkeptmult=115 
Total energy=-1.94187629188  Egs=-0.639834456031
Kept: 58 out of 257, ratio=0.226
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=18 min=1 max=34 sum3=119096
Emax=10.0487290416 nrkept=70 nrkeptmult=144 
Total energy=-1.94187629414  Egs=-1.58856987491
Kept: 70 out of 212, ratio=0.33
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=41 sum3=166697
Emax=10.513947406 nrkept=58 nrkeptmult=115 
Total energy=-1.9418762946  Egs=-0.639820674347
Kept: 58 out of 257, ratio=0.226
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=18 min=1 max=34 sum3=119096
Emax=10.0489861418 nrkept=70 nrkeptmult=144 
Total energy=-1.94187629517  Egs=-1.58856392334
Kept: 70 out of 212, ratio=0.33
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=41 sum3=166697
Emax=10.5146403856 nrkept=58 nrkeptmult=115 
Total energy=-1.94187629528  Egs=-0.639817217193
Kept: 58 out of 257, ratio=0.226
Memory used: 8 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -1.941876295279678
TKW=1.22458408901e-05
Grand canonical Z=              6.103602973575007
Zft (last shell)=               6.102273574009472

Memory usage report
===================
  after diag: 9100 kB
after recalc: 9116 kB
 after split: 9112 kB
  after trim: 9116 kB
 after trunc: 9100 kB
      diag_h: 9100 kB

Peak usage: 9116 kB

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