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=	0.004	 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
0.0123667733376 
(-1 2) 2 states
0.00581521959704 0.0185915743638 
(0 1) 3 states
0 0.0136568555799 0.0257307334344 
(0 3) 1 states
0.0120400206232 
(1 2) 2 states
0.00695722868547 0.0200635869912 
(2 1) 1 states
0.0149807950536 
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=1.55207201194 nrkept=35 nrkeptmult=64 
Total energy=-1.17899955969  Egs=-0.749016593494
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=4.59809083295 nrkept=126 nrkeptmult=256 
Total energy=-1.75246206347  Egs=-0.749521719064
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 3 states
Emax=10.0017286879 nrkept=397 nrkeptmult=895 
Total energy=-2.54678319755  Egs=-2.07637269391
Kept: 397 out of 462, ratio=0.859
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=177 sum3=22302261
Safeguard: keep additional 1 states
Emax=10.0511722767 nrkept=414 nrkeptmult=964 
Total energy=-2.69002903523  Egs=-0.748895460832
Kept: 414 out of 1479, ratio=0.28
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=10.0526537312 nrkept=263 nrkeptmult=585 
Total energy=-2.84899719468  Egs=-1.66218488367
Kept: 263 out of 1549, ratio=0.17
Memory used: 10 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=6462933
Emax=10.0521061832 nrkept=165 nrkeptmult=340 
Total energy=-2.88069262533  Egs=-0.662820352153
Kept: 165 out of 975, 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=10.1050394734 nrkept=245 nrkeptmult=549 
Total energy=-2.91779135673  Egs=-1.55163023234
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=10.0261503354 nrkept=157 nrkeptmult=323 
Total energy=-2.9266796241  Egs=-0.743491965412
Kept: 157 out of 913, ratio=0.172
Memory used: 12 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=10.0087097131 nrkept=217 nrkeptmult=491 
Total energy=-2.93509781663  Egs=-1.40834163725
Kept: 217 out of 578, ratio=0.375
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/34 (scale 0.0029886897849515323) ***** 
[1] xi(9)=1.00002099553 zeta(10)=0
Stats: nr=26 min=1 max=102 sum3=4051724
Emax=10.0217813068 nrkept=146 nrkeptmult=301 
Total energy=-2.9376984886  Egs=-0.870171265117
Kept: 146 out of 812, ratio=0.18
Memory used: 12 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=87 sum3=1576221
Emax=10.0106952954 nrkept=166 nrkeptmult=372 
Total energy=-2.93951418115  Egs=-1.21504249587
Kept: 166 out of 537, ratio=0.309
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/34 (scale 0.00074717244623788307) ***** 
[1] xi(11)=1.0000013119 zeta(12)=0
Stats: nr=25 min=1 max=83 sum3=1899019
Emax=10.0144300685 nrkept=118 nrkeptmult=252 
Total energy=-2.94030252258  Egs=-1.05509971375
Kept: 118 out of 619, ratio=0.191
Memory used: 12 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=71 sum3=871992
Emax=10.0334679127 nrkept=134 nrkeptmult=306 
Total energy=-2.94066861588  Egs=-0.979943255552
Kept: 134 out of 438, ratio=0.306
Memory used: 12 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=69 sum3=1056609
Emax=10.0511480277 nrkept=99 nrkeptmult=214 
Total energy=-2.94091403352  Egs=-1.31384738409
Kept: 99 out of 501, ratio=0.198
Memory used: 12 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=58 sum3=495781
Emax=10.0394115975 nrkept=106 nrkeptmult=241 
Total energy=-2.94099584371  Egs=-0.875944360311
Kept: 106 out of 367, ratio=0.289
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 16/34 (scale 4.6698277889867692e-05) ***** 
[1] xi(15)=1.00000000512 zeta(16)=0
Stats: nr=24 min=1 max=55 sum3=552840
Emax=10.0701782537 nrkept=82 nrkeptmult=175 
Total energy=-2.94105898414  Egs=-1.35209341615
Kept: 82 out of 396, ratio=0.207
Memory used: 12 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=49 sum3=288915
Emax=10.0183642021 nrkept=84 nrkeptmult=182 
Total energy=-2.94107847666  Egs=-0.834828189017
Kept: 84 out of 303, ratio=0.277
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/34 (scale 1.1674569472466923e-05) ***** 
[1] xi(17)=1.00000000032 zeta(18)=0
Stats: nr=23 min=1 max=46 sum3=295968
Emax=10.0902873401 nrkept=73 nrkeptmult=154 
Total energy=-2.94109410941  Egs=-1.33904234718
Kept: 73 out of 312, ratio=0.234
Memory used: 12 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=43 sum3=197165
Emax=10.0782553333 nrkept=65 nrkeptmult=134 
Total energy=-2.94109889315  Egs=-0.819515565493
Kept: 65 out of 269, ratio=0.242
Memory used: 12 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=36 sum3=135947
Emax=10.1191737814 nrkept=68 nrkeptmult=141 
Total energy=-2.94110278449  Egs=-1.33327088755
Kept: 68 out of 239, ratio=0.285
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 21/34 (scale 1.4593211840583654e-06) ***** 
[1] xi(20)=1.00000000001 zeta(21)=0
Stats: nr=20 min=1 max=40 sum3=158031
Emax=10.0337943261 nrkept=60 nrkeptmult=118 
Total energy=-2.94110397388  Egs=-0.81502532579
Kept: 60 out of 249, ratio=0.241
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/34 (scale 7.2966059202918268e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=19 min=1 max=33 sum3=115527
Emax=10.3630094543 nrkept=68 nrkeptmult=139 
Total energy=-2.94110494547  Egs=-1.33156517048
Kept: 68 out of 219, ratio=0.311
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 23/34 (scale 3.6483029601459134e-07) ***** 
[1] xi(22)=1 zeta(23)=0
Stats: nr=20 min=1 max=41 sum3=164187
Emax=10.1820981073 nrkept=60 nrkeptmult=118 
Total energy=-2.94110524238  Egs=-0.813847125226
Kept: 60 out of 249, ratio=0.241
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/34 (scale 1.8241514800729567e-07) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=19 min=1 max=34 sum3=117927
Emax=10.3905628085 nrkept=68 nrkeptmult=139 
Total energy=-2.9411054852  Egs=-1.33111922247
Kept: 68 out of 219, ratio=0.311
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 25/34 (scale 9.1207574003647835e-08) ***** 
[1] xi(24)=1 zeta(25)=0
Stats: nr=20 min=1 max=41 sum3=164187
Emax=10.0286182443 nrkept=58 nrkeptmult=115 
Total energy=-2.9411055594  Egs=-0.813548697035
Kept: 58 out of 249, ratio=0.233
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/34 (scale 4.5603787001823918e-08) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.3974584025 nrkept=68 nrkeptmult=139 
Total energy=-2.9411056201  Egs=-1.33100571715
Kept: 68 out of 212, ratio=0.321
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 27/34 (scale 2.2801893500911959e-08) ***** 
[1] xi(26)=1 zeta(27)=0
Stats: nr=20 min=1 max=41 sum3=164187
Emax=10.0431279116 nrkept=58 nrkeptmult=115 
Total energy=-2.94110563865  Egs=-0.813474510444
Kept: 58 out of 249, ratio=0.233
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/34 (scale 1.1400946750455979e-08) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.0004509237 nrkept=67 nrkeptmult=137 
Total energy=-2.94110565382  Egs=-1.33097678567
Kept: 67 out of 212, ratio=0.316
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 29/34 (scale 5.7004733752279897e-09) ***** 
[1] xi(28)=1 zeta(29)=0
Stats: nr=20 min=1 max=40 sum3=155129
Emax=10.0468112379 nrkept=58 nrkeptmult=115 
Total energy=-2.94110565846  Egs=-0.813456291853
Kept: 58 out of 245, ratio=0.237
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/34 (scale 2.8502366876139948e-09) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.0007255066 nrkept=67 nrkeptmult=137 
Total energy=-2.94110566225  Egs=-1.33096907785
Kept: 67 out of 212, ratio=0.316
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 31/34 (scale 1.4251183438069974e-09) ***** 
[1] xi(30)=1 zeta(31)=0
Stats: nr=20 min=1 max=40 sum3=155129
Emax=10.0477223947 nrkept=58 nrkeptmult=115 
Total energy=-2.94110566341  Egs=-0.813452091112
Kept: 58 out of 245, ratio=0.237
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/34 (scale 7.1255917190349871e-10) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.000792749 nrkept=67 nrkeptmult=137 
Total energy=-2.94110566436  Egs=-1.33096668207
Kept: 67 out of 212, ratio=0.316
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/34 (scale 3.5627958595174936e-10) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=20 min=1 max=40 sum3=155129
Emax=10.0479527494 nrkept=58 nrkeptmult=115 
Total energy=-2.94110566465  Egs=-0.813451396276
Kept: 58 out of 245, ratio=0.237
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 34/34 (scale 1.7813979297587468e-10) ***** 
[1] xi(33)=1 zeta(34)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.0008081568 nrkept=67 nrkeptmult=137 
Total energy=-2.94110566489  Egs=-1.33096561459
Kept: 67 out of 212, ratio=0.316
Memory used: 12 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -2.941105664889059
TKW=7.05835997504e-05
Grand canonical Z=              4.579937057282032
Zft (last shell)=               4.579130987201478

Memory usage report
===================
  after diag: 12784 kB
after recalc: 12796 kB
 after split: 12792 kB
  after trim: 12796 kB
 after trunc: 12784 kB
      diag_h: 12784 kB

Peak usage: 12796 kB

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