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=34
TEMPERATURE T=1.78139792976e-10
Nmax=34
Tmin=1e-10
Ninit=0
Lambda=4
strategy=kept
lastall=0
lastalloverride=0
z=0.25
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=	0.005	 t=	0.
>> 
>>  Gamma^(1/2)=	0.019544100476116797
>>  Lambda=	4.	 BAND=	flat
>>  DISCRETIZATION=	Z	 z=	0.25
>>  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=0.25
# keep=5000 keepenergy=10 Nmax=34 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.0120729126441 
(-1 2) 2 states
0.00568682476127 0.0184590005269 
(0 1) 3 states
0 0.0136803808923 0.0258058841848 
(0 3) 1 states
0.0120729126441 
(1 2) 2 states
0.00711491606785 0.0202984363652 
(2 1) 1 states
0.015340439789 
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 1/34 (scale 1.5302091698951845) ***** 
[1] xi(0)=0.386339012483 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=1.55272834103 nrkept=35 nrkeptmult=64 
Total energy=-1.17800493803  Egs=-0.748954324223
Kept: 35 out of 35, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/34 (scale 0.76510458494759226) ***** 
[1] xi(1)=0.825210335354 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=4.59850175882 nrkept=126 nrkeptmult=256 
Total energy=-1.75159302138  Egs=-0.749685852932
Kept: 126 out of 126, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/34 (scale 0.38255229247379613) ***** 
[1] xi(2)=1.34995585906 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Safeguard: keep additional 11 states
Emax=10.0017600443 nrkept=405 nrkeptmult=911 
Total energy=-2.54579642937  Egs=-2.07606495533
Kept: 405 out of 462, ratio=0.877
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/34 (scale 0.19127614623689806) ***** 
[1] xi(3)=1.19788354053 zeta(4)=0
Stats: nr=28 min=1 max=181 sum3=23578813
Safeguard: keep additional 1 states
Emax=10.0511600768 nrkept=414 nrkeptmult=964 
Total energy=-2.68923403895  Egs=-0.749898052659
Kept: 414 out of 1507, ratio=0.275
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/34 (scale 0.095638073118449032) ***** 
[1] xi(4)=1.03290972714 zeta(5)=0
Stats: nr=33 min=1 max=202 sum3=23679109
Emax=10.0526482629 nrkept=263 nrkeptmult=586 
Total energy=-2.84804897738  Egs=-1.66058279145
Kept: 263 out of 1549, ratio=0.17
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/34 (scale 0.047819036559224516) ***** 
[1] xi(5)=1.00586473051 zeta(6)=0
Stats: nr=28 min=1 max=117 sum3=6526420
Emax=10.0485114361 nrkept=165 nrkeptmult=340 
Total energy=-2.87998909982  Egs=-0.667937389323
Kept: 165 out of 976, ratio=0.169
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/34 (scale 0.023909518279612258) ***** 
[1] xi(6)=1.00136705755 zeta(7)=0
Stats: nr=23 min=1 max=97 sum3=2209770
Emax=10.1478340901 nrkept=245 nrkeptmult=549 
Total energy=-2.91695530031  Egs=-1.54608721367
Kept: 245 out of 606, ratio=0.404
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/34 (scale 0.011954759139806129) ***** 
[1] xi(7)=1.00033724249 zeta(8)=0
Stats: nr=27 min=1 max=112 sum3=5439853
Emax=10.0256020361 nrkept=157 nrkeptmult=323 
Total energy=-2.92604074329  Egs=-0.759985447657
Kept: 157 out of 913, ratio=0.172
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/34 (scale 0.0059773795699030645) ***** 
[1] xi(8)=1.00008404709 zeta(9)=0
Stats: nr=21 min=1 max=93 sum3=1945688
Emax=10.0111983041 nrkept=227 nrkeptmult=512 
Total energy=-2.93444857133  Egs=-1.4066076845
Kept: 227 out of 578, ratio=0.393
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/34 (scale 0.0029886897849515323) ***** 
[1] xi(9)=1.00002099553 zeta(10)=0
Stats: nr=27 min=1 max=105 sum3=4299029
Emax=10.0168542003 nrkept=145 nrkeptmult=300 
Total energy=-2.93708867349  Egs=-0.883364401235
Kept: 145 out of 845, ratio=0.172
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/34 (scale 0.0014943448924757661) ***** 
[1] xi(10)=1.00000524787 zeta(11)=0
Stats: nr=21 min=1 max=86 sum3=1534596
Emax=10.0082041221 nrkept=159 nrkeptmult=355 
Total energy=-2.93899131678  Egs=-1.27322902735
Kept: 159 out of 534, ratio=0.298
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/34 (scale 0.00074717244623788307) ***** 
[1] xi(11)=1.0000013119 zeta(12)=0
Stats: nr=24 min=2 max=81 sum3=1752274
Emax=10.0683059292 nrkept=112 nrkeptmult=238 
Total energy=-2.93971063978  Egs=-0.962726882905
Kept: 112 out of 592, ratio=0.189
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/34 (scale 0.00037358622311894153) ***** 
[1] xi(12)=1.00000032797 zeta(13)=0
Stats: nr=20 min=1 max=66 sum3=736668
Emax=10.0896067764 nrkept=122 nrkeptmult=269 
Total energy=-2.94015690342  Egs=-1.1945398707
Kept: 122 out of 414, ratio=0.295
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 14/34 (scale 0.00018679311155947077) ***** 
[1] xi(13)=1.00000008199 zeta(14)=0
Stats: nr=24 min=1 max=65 sum3=821073
Emax=10.0143417902 nrkept=91 nrkeptmult=193 
Total energy=-2.94033826182  Egs=-0.970905167174
Kept: 91 out of 453, ratio=0.201
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 15/34 (scale 9.3396555779735383e-05) ***** 
[1] xi(14)=1.0000000205 zeta(15)=0
Stats: nr=20 min=1 max=53 sum3=379200
Emax=10.077137185 nrkept=84 nrkeptmult=177 
Total energy=-2.94044725863  Egs=-1.16703241748
Kept: 84 out of 336, ratio=0.25
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 16/34 (scale 4.6698277889867692e-05) ***** 
[1] xi(15)=1.00000000512 zeta(16)=0
Stats: nr=20 min=1 max=48 sum3=308500
Emax=10.042919712 nrkept=71 nrkeptmult=148 
Total energy=-2.94049217172  Egs=-0.961771928454
Kept: 71 out of 310, ratio=0.229
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 17/34 (scale 2.3349138944933846e-05) ***** 
[1] xi(16)=1.00000000128 zeta(17)=0
Stats: nr=20 min=1 max=42 sum3=190875
Emax=10.155689743 nrkept=67 nrkeptmult=140 
Total energy=-2.94051927018  Egs=-1.16057648742
Kept: 67 out of 261, ratio=0.257
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/34 (scale 1.1674569472466923e-05) ***** 
[1] xi(17)=1.00000000032 zeta(18)=0
Stats: nr=20 min=1 max=40 sum3=155592
Emax=10.1691190662 nrkept=61 nrkeptmult=125 
Total energy=-2.94053044767  Egs=-0.957421995668
Kept: 61 out of 246, ratio=0.248
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 19/34 (scale 5.8372847362334614e-06) ***** 
[1] xi(18)=1.00000000008 zeta(19)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.0045184361 nrkept=63 nrkeptmult=131 
Total energy=-2.94053721396  Egs=-1.159149699
Kept: 63 out of 224, ratio=0.281
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/34 (scale 2.9186423681167307e-06) ***** 
[1] xi(19)=1.00000000002 zeta(20)=0
Stats: nr=20 min=1 max=37 sum3=127846
Emax=10.0391606487 nrkept=58 nrkeptmult=116 
Total energy=-2.9405400046  Egs=-0.956145833678
Kept: 58 out of 232, ratio=0.25
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 21/34 (scale 1.4593211840583654e-06) ***** 
[1] xi(20)=1.00000000001 zeta(21)=0
Stats: nr=19 min=1 max=33 sum3=100508
Emax=10.0641954437 nrkept=61 nrkeptmult=125 
Total energy=-2.94054169568  Egs=-1.15881168155
Kept: 61 out of 212, ratio=0.288
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/34 (scale 7.2966059202918268e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.0863846395 nrkept=58 nrkeptmult=116 
Total energy=-2.9405423931  Egs=-0.955813646065
Kept: 58 out of 224, ratio=0.259
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 23/34 (scale 3.6483029601459134e-07) ***** 
[1] xi(22)=1 zeta(23)=0
Stats: nr=19 min=1 max=33 sum3=100508
Emax=10.0881659847 nrkept=61 nrkeptmult=125 
Total energy=-2.94054281584  Egs=-1.15872837234
Kept: 61 out of 212, ratio=0.288
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/34 (scale 1.8241514800729567e-07) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.0981898982 nrkept=58 nrkeptmult=116 
Total energy=-2.94054299018  Egs=-0.955729833582
Kept: 58 out of 224, ratio=0.259
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 25/34 (scale 9.1207574003647835e-08) ***** 
[1] xi(24)=1 zeta(25)=0
Stats: nr=19 min=1 max=33 sum3=100508
Emax=10.094213608 nrkept=61 nrkeptmult=125 
Total energy=-2.94054309586  Egs=-1.15870753139
Kept: 61 out of 212, ratio=0.288
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/34 (scale 4.5603787001823918e-08) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.1011410836 nrkept=58 nrkeptmult=116 
Total energy=-2.94054313945  Egs=-0.955708913295
Kept: 58 out of 224, ratio=0.259
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 27/34 (scale 2.2801893500911959e-08) ***** 
[1] xi(26)=1 zeta(27)=0
Stats: nr=19 min=1 max=33 sum3=100508
Emax=10.0957292 nrkept=61 nrkeptmult=125 
Total energy=-2.94054316587  Egs=-1.158702229
Kept: 61 out of 212, ratio=0.288
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/34 (scale 1.1400946750455979e-08) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=20 min=1 max=35 sum3=113342
Emax=10.1018786757 nrkept=58 nrkeptmult=116 
Total energy=-2.94054317676  Egs=-0.955703767192
Kept: 58 out of 224, ratio=0.259
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 29/34 (scale 5.7004733752279897e-09) ***** 
[1] xi(28)=1 zeta(29)=0
Stats: nr=19 min=1 max=33 sum3=100508
Emax=10.0961084742 nrkept=61 nrkeptmult=125 
Total energy=-2.94054318337  Egs=-1.15870080615
Kept: 61 out of 212, ratio=0.288
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/34 (scale 2.8502366876139948e-09) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=20 min=1 max=35 sum3=113342
Safeguard: keep additional 1 states
Emax=10.1020712508 nrkept=59 nrkeptmult=118 
Total energy=-2.94054318609  Egs=-0.955702568059
Kept: 59 out of 224, ratio=0.263
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 31/34 (scale 1.4251183438069974e-09) ***** 
[1] xi(30)=1 zeta(31)=0
Stats: nr=19 min=1 max=34 sum3=106482
Safeguard: keep additional 3 states
Emax=10.0962093486 nrkept=64 nrkeptmult=132 
Total energy=-2.94054318775  Egs=-1.15870035281
Kept: 64 out of 216, ratio=0.296
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/34 (scale 7.1255917190349871e-10) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=20 min=1 max=38 sum3=135721
Safeguard: keep additional 2 states
Emax=10.1021159525 nrkept=60 nrkeptmult=120 
Total energy=-2.94054318843  Egs=-0.95570235712
Kept: 60 out of 235, ratio=0.255
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/34 (scale 3.5627958595174936e-10) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=19 min=1 max=35 sum3=112972
Safeguard: keep additional 5 states
Emax=10.0962311133 nrkept=66 nrkeptmult=136 
Total energy=-2.94054318884  Egs=-1.15870014105
Kept: 66 out of 220, ratio=0.3
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 34/34 (scale 1.7813979297587468e-10) ***** 
[1] xi(33)=1 zeta(34)=0
Stats: nr=20 min=1 max=40 sum3=152690
Safeguard: keep additional 2 states
Emax=10.1021215945 nrkept=60 nrkeptmult=120 
Total energy=-2.94054318901  Egs=-0.955702394216
Kept: 60 out of 242, ratio=0.248
Memory used: 11 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -2.940543189009416
TKW=0.000361076263659
Grand canonical Z=              5.089742231923851
Zft (last shell)=               5.088639148137316

Memory usage report
===================
  after diag: 11932 kB
after recalc: 11944 kB
 after split: 11936 kB
  after trim: 11944 kB
 after trunc: 11932 kB
      diag_h: 11932 kB

Peak usage: 11944 kB

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