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=1.25963855612e-10
Nmax=34
Tmin=1e-10
Ninit=0
Lambda=4
strategy=kept
lastall=0
lastalloverride=0
z=0.5
discretization=Z
band=flat
betabar=1
T=1.25963855612e-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=	0.5
>>  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=0.5
# keep=5000 keepenergy=10 Nmax=34 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.0359823587306 
(-1 2) 2 states
0.0173848400331 0.0522693868263 
(0 1) 3 states
0 0.0359823587306 0.0696542268594 
(0 3) 1 states
0.0336718681288 
(1 2) 2 states
0.0173848400331 0.0522693868263 
(2 1) 1 states
0.0359823587306 
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 1.0820212806667227) ***** 
[1] xi(0)=0.583236763744 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=2.34168657753 nrkept=35 nrkeptmult=64 
Total energy=-1.26437735477  Egs=-1.1011890619
Kept: 35 out of 35, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/34 (scale 0.54101064033336133) ***** 
[1] xi(1)=1.00512796777 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=6.34466125445 nrkept=126 nrkeptmult=256 
Total energy=-1.71376462399  Egs=-0.830644049702
Kept: 126 out of 126, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/34 (scale 0.27050532016668066) ***** 
[1] xi(2)=1.15987983857 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Safeguard: keep additional 3 states
Emax=10.3976221735 nrkept=327 nrkeptmult=736 
Total energy=-2.18408782444  Egs=-1.73868373517
Kept: 327 out of 462, ratio=0.708
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/34 (scale 0.13525266008334033) ***** 
[1] xi(3)=1.05145618663 zeta(4)=0
Stats: nr=28 min=1 max=144 sum3=12315748
Safeguard: keep additional 9 states
Emax=10.3459257835 nrkept=270 nrkeptmult=600 
Total energy=-2.28315055634  Egs=-0.732427235401
Kept: 270 out of 1216, ratio=0.222
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/34 (scale 0.067626330041670166) ***** 
[1] xi(4)=1.0092748627 zeta(5)=0
Stats: nr=29 min=1 max=145 sum3=7991716
Safeguard: keep additional 1 states
Emax=10.667838896 nrkept=264 nrkeptmult=594 
Total energy=-2.38390387244  Egs=-1.4898533757
Kept: 264 out of 1006, ratio=0.262
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/34 (scale 0.033813165020835083) ***** 
[1] xi(5)=1.0019706562 zeta(6)=0
Stats: nr=28 min=1 max=116 sum3=6400760
Emax=10.0424577021 nrkept=157 nrkeptmult=323 
Total energy=-2.41142254517  Egs=-0.813844924321
Kept: 157 out of 980, ratio=0.16
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/34 (scale 0.016906582510417541) ***** 
[1] xi(6)=1.00047537742 zeta(7)=0
Stats: nr=21 min=1 max=94 sum3=1975880
Safeguard: keep additional 2 states
Emax=10.0059825192 nrkept=209 nrkeptmult=476 
Total energy=-2.43342229408  Egs=-1.30125345544
Kept: 209 out of 578, ratio=0.362
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/34 (scale 0.0084532912552087707) ***** 
[1] xi(7)=1.00011790809 zeta(8)=0
Stats: nr=26 min=1 max=95 sum3=3507342
Emax=10.2181914614 nrkept=157 nrkeptmult=323 
Total energy=-2.44157937906  Egs=-0.96495965087
Kept: 157 out of 780, ratio=0.201
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/34 (scale 0.0042266456276043854) ***** 
[1] xi(8)=1.00002942047 zeta(9)=0
Stats: nr=21 min=1 max=94 sum3=1975880
Safeguard: keep additional 4 states
Emax=10.0037434837 nrkept=191 nrkeptmult=424 
Total energy=-2.44615511812  Egs=-1.0825934951
Kept: 191 out of 578, ratio=0.33
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/34 (scale 0.0021133228138021927) ***** 
[1] xi(9)=1.00000735161 zeta(10)=0
Stats: nr=25 min=2 max=90 sum3=2875702
Safeguard: keep additional 3 states
Emax=10.0003453178 nrkept=136 nrkeptmult=284 
Total energy=-2.44859183695  Egs=-1.15302726604
Kept: 136 out of 712, ratio=0.191
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/34 (scale 0.0010566614069010963) ***** 
[1] xi(10)=1.00000183768 zeta(11)=0
Stats: nr=21 min=1 max=79 sum3=1214363
Safeguard: keep additional 3 states
Emax=10.0394009844 nrkept=142 nrkeptmult=314 
Total energy=-2.44949236164  Egs=-0.852235808665
Kept: 142 out of 503, ratio=0.282
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/34 (scale 0.00052833070345054817) ***** 
[1] xi(11)=1.00000045941 zeta(12)=0
Stats: nr=25 min=1 max=67 sum3=1210188
Safeguard: keep additional 1 states
Emax=10.0089297622 nrkept=98 nrkeptmult=208 
Total energy=-2.45023158676  Egs=-1.39917123318
Kept: 98 out of 528, ratio=0.186
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/34 (scale 0.00026416535172527408) ***** 
[1] xi(12)=1.00000011485 zeta(13)=0
Stats: nr=21 min=1 max=57 sum3=449984
Emax=10.0202043208 nrkept=98 nrkeptmult=222 
Total energy=-2.45040748764  Egs=-0.665874166611
Kept: 98 out of 362, ratio=0.271
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 14/34 (scale 0.00013208267586263704) ***** 
[1] xi(13)=1.00000002871 zeta(14)=0
Stats: nr=23 min=1 max=48 sum3=445560
Safeguard: keep additional 3 states
Emax=10.1234892861 nrkept=83 nrkeptmult=173 
Total energy=-2.45062218899  Egs=-1.62550723262
Kept: 83 out of 366, ratio=0.227
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 15/34 (scale 6.6041337931318521e-05) ***** 
[1] xi(14)=1.00000000718 zeta(15)=0
Stats: nr=21 min=1 max=48 sum3=267870
Emax=10.0157534153 nrkept=77 nrkeptmult=166 
Total energy=-2.45066011259  Egs=-0.57424046748
Kept: 77 out of 306, ratio=0.252
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 16/34 (scale 3.3020668965659261e-05) ***** 
[1] xi(15)=1.00000000179 zeta(16)=0
Stats: nr=23 min=1 max=39 sum3=231458
Safeguard: keep additional 1 states
Emax=10.0510178185 nrkept=76 nrkeptmult=158 
Total energy=-2.45071744576  Egs=-1.73628110154
Kept: 76 out of 284, ratio=0.268
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 17/34 (scale 1.651033448282963e-05) ***** 
[1] xi(16)=1.00000000045 zeta(17)=0
Stats: nr=21 min=1 max=43 sum3=198842
Emax=11.1947996852 nrkept=72 nrkeptmult=148 
Total energy=-2.45072642974  Egs=-0.544143107274
Kept: 72 out of 278, ratio=0.259
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/34 (scale 8.2551672414148151e-06) ***** 
[1] xi(17)=1.00000000011 zeta(18)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.3505676745 nrkept=74 nrkeptmult=154 
Total energy=-2.45074105099  Egs=-1.7711624664
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 19/34 (scale 4.1275836207074076e-06) ***** 
[1] xi(18)=1.00000000003 zeta(19)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.7539275131 nrkept=72 nrkeptmult=148 
Total energy=-2.45074326311  Egs=-0.535937468884
Kept: 72 out of 270, ratio=0.267
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/34 (scale 2.0637918103537038e-06) ***** 
[1] xi(19)=1.00000000001 zeta(20)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5172705487 nrkept=74 nrkeptmult=154 
Total energy=-2.4507469376  Egs=-1.78045344837
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 21/34 (scale 1.0318959051768519e-06) ***** 
[1] xi(20)=1 zeta(21)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9121389511 nrkept=72 nrkeptmult=148 
Total energy=-2.45074748846  Egs=-0.53383664599
Kept: 72 out of 270, ratio=0.267
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/34 (scale 5.1594795258842595e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5609081144 nrkept=74 nrkeptmult=154 
Total energy=-2.4507484083  Egs=-1.78281421313
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 23/34 (scale 2.5797397629421297e-07) ***** 
[1] xi(22)=1 zeta(23)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.952876192 nrkept=72 nrkeptmult=148 
Total energy=-2.45074854588  Egs=-0.533308215343
Kept: 72 out of 270, ratio=0.267
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/34 (scale 1.2898698814710649e-07) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5719406219 nrkept=74 nrkeptmult=154 
Total energy=-2.45074877592  Egs=-1.78340681923
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 25/34 (scale 6.4493494073553243e-08) ***** 
[1] xi(24)=1 zeta(25)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9631343073 nrkept=72 nrkeptmult=148 
Total energy=-2.4507488103  Egs=-0.533175903877
Kept: 72 out of 270, ratio=0.267
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/34 (scale 3.2246747036776622e-08) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5747064395 nrkept=74 nrkeptmult=154 
Total energy=-2.45074886782  Egs=-1.78355512221
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 27/34 (scale 1.6123373518388311e-08) ***** 
[1] xi(26)=1 zeta(27)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9657034405 nrkept=72 nrkeptmult=148 
Total energy=-2.45074887641  Egs=-0.533142813251
Kept: 72 out of 270, ratio=0.267
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/34 (scale 8.0616867591941554e-09) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5753983741 nrkept=74 nrkeptmult=154 
Total energy=-2.45074889079  Egs=-1.78359220741
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 29/34 (scale 4.0308433795970777e-09) ***** 
[1] xi(28)=1 zeta(29)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9663460112 nrkept=72 nrkeptmult=148 
Total energy=-2.45074889294  Egs=-0.5331345398
Kept: 72 out of 270, ratio=0.267
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/34 (scale 2.0154216897985389e-09) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5755713877 nrkept=74 nrkeptmult=154 
Total energy=-2.45074889653  Egs=-1.78360147929
Kept: 74 out of 264, ratio=0.28
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 31/34 (scale 1.0077108448992694e-09) ***** 
[1] xi(30)=1 zeta(31)=0
Stats: nr=21 min=1 max=41 sum3=176130
Safeguard: keep additional 10 states
Emax=11.9665244884 nrkept=82 nrkeptmult=182 
Total energy=-2.45074889707  Egs=-0.533132471389
Kept: 82 out of 270, ratio=0.304
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/34 (scale 5.0385542244963471e-10) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=23 min=1 max=40 sum3=253576
Safeguard: keep additional 1 states
Emax=10.5756018733 nrkept=74 nrkeptmult=154 
Total energy=-2.45074889797  Egs=-1.7836037973
Kept: 74 out of 304, ratio=0.243
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/34 (scale 2.5192771122481736e-10) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=21 min=1 max=41 sum3=176130
Safeguard: keep additional 15 states
Emax=11.9665604213 nrkept=87 nrkeptmult=192 
Total energy=-2.45074889811  Egs=-0.533131954347
Kept: 87 out of 270, ratio=0.322
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 34/34 (scale 1.2596385561240868e-10) ***** 
[1] xi(33)=1 zeta(34)=0
Stats: nr=25 min=1 max=42 sum3=287376
Safeguard: keep additional 1 states
Emax=10.5756111461 nrkept=74 nrkeptmult=154 
Total energy=-2.45074889833  Egs=-1.78360437676
Kept: 74 out of 324, ratio=0.228
Memory used: 8 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -2.450748898329811
TKW=0.000307041437086
Grand canonical Z=              4.417040618417921
Zft (last shell)=               4.416463389866913

Memory usage report
===================
  after diag: 9004 kB
after recalc: 9024 kB
 after split: 9016 kB
  after trim: 9024 kB
 after trunc: 9004 kB
      diag_h: 9004 kB

Peak usage: 9024 kB

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