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=	0.0031831	 Delta=	0	 t=	0.
>> 
>>  Gamma^(1/2)=	0.04501582385587593
>>  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
0.0302463064728 
(-1 2) 2 states
0.0146977163255 0.0441611330476 
(0 1) 3 states
0 0.0302463064728 0.0588588493731 
(0 3) 1 states
0.0286125429003 
(1 2) 2 states
0.0146977163255 0.0441611330476 
(2 1) 1 states
0.0302463064728 
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=1.55305997439 nrkept=35 nrkeptmult=64 
Total energy=-1.1857533071  Egs=-0.717671137822
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=4.6966238557 nrkept=126 nrkeptmult=256 
Total energy=-1.79420422288  Egs=-0.795251953458
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 1 states
Emax=10.0053337004 nrkept=394 nrkeptmult=884 
Total energy=-2.55481064128  Egs=-1.98824169496
Kept: 394 out of 462, ratio=0.853
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=175 sum3=21847346
Safeguard: keep additional 3 states
Emax=10.0537929573 nrkept=416 nrkeptmult=966 
Total energy=-2.71654322348  Egs=-0.845544964072
Kept: 416 out of 1466, ratio=0.284
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=203 sum3=23998447
Safeguard: keep additional 1 states
Emax=10.0552253271 nrkept=264 nrkeptmult=586 
Total energy=-2.85901235497  Egs=-1.4896696142
Kept: 264 out of 1555, 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=6543378
Safeguard: keep additional 3 states
Emax=10.0429184653 nrkept=160 nrkeptmult=332 
Total energy=-2.89893231226  Egs=-0.834813082138
Kept: 160 out of 978, ratio=0.164
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/34 (scale 0.023909518279612258) ***** 
[1] xi(6)=1.00136705755 zeta(7)=0
Stats: nr=21 min=1 max=95 sum3=2064914
Safeguard: keep additional 2 states
Emax=10.0037145604 nrkept=209 nrkeptmult=476 
Total energy=-2.92939809781  Egs=-1.27421160016
Kept: 209 out of 590, ratio=0.354
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/34 (scale 0.011954759139806129) ***** 
[1] xi(7)=1.00033724249 zeta(8)=0
Stats: nr=26 min=1 max=95 sum3=3507342
Emax=10.2192662861 nrkept=157 nrkeptmult=323 
Total energy=-2.94147541249  Egs=-1.01025161158
Kept: 157 out of 780, ratio=0.201
Memory used: 10 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=94 sum3=1975880
Emax=10.4805413889 nrkept=201 nrkeptmult=446 
Total energy=-2.94763005324  Egs=-1.02965533173
Kept: 201 out of 578, ratio=0.348
Memory used: 10 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=94 sum3=3271438
Emax=10.1204637931 nrkept=138 nrkeptmult=288 
Total energy=-2.95131508559  Egs=-1.232992587
Kept: 138 out of 748, ratio=0.184
Memory used: 10 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=81 sum3=1286250
Safeguard: keep additional 2 states
Emax=10.1622078153 nrkept=148 nrkeptmult=324 
Total energy=-2.9524949341  Egs=-0.789542308888
Kept: 148 out of 510, ratio=0.29
Memory used: 10 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=71 sum3=1411012
Emax=10.0937022413 nrkept=96 nrkeptmult=200 
Total energy=-2.95360716391  Egs=-1.48858514878
Kept: 96 out of 550, ratio=0.175
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/34 (scale 0.00037358622311894153) ***** 
[1] xi(12)=1.00000032797 zeta(13)=0
Stats: nr=21 min=1 max=57 sum3=438786
Safeguard: keep additional 1 states
Emax=10.0109678678 nrkept=97 nrkeptmult=218 
Total energy=-2.95384161749  Egs=-0.627575556555
Kept: 97 out of 354, ratio=0.274
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 14/34 (scale 0.00018679311155947077) ***** 
[1] xi(13)=1.00000008199 zeta(14)=0
Stats: nr=23 min=1 max=48 sum3=436898
Emax=10.0375086099 nrkept=79 nrkeptmult=165 
Total energy=-2.95415484708  Egs=-1.67687975087
Kept: 79 out of 362, ratio=0.218
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 15/34 (scale 9.3396555779735383e-05) ***** 
[1] xi(14)=1.0000000205 zeta(15)=0
Stats: nr=21 min=1 max=46 sum3=235436
Emax=10.3429351556 nrkept=72 nrkeptmult=148 
Total energy=-2.95420719531  Egs=-0.560494247587
Kept: 72 out of 290, ratio=0.248
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.0471504013 nrkept=74 nrkeptmult=154 
Total energy=-2.95428908176  Egs=-1.75352188007
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.4512024165 nrkept=72 nrkeptmult=148 
Total energy=-2.95430169694  Egs=-0.540284613312
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.4308666193 nrkept=74 nrkeptmult=154 
Total energy=-2.95432242908  Egs=-1.77583699086
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.829629984 nrkept=72 nrkeptmult=148 
Total energy=-2.95432555168  Egs=-0.534941443861
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5386212417 nrkept=74 nrkeptmult=154 
Total energy=-2.95433075167  Egs=-1.78164662489
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9318160792 nrkept=72 nrkeptmult=148 
Total energy=-2.95433153034  Egs=-0.533585573899
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5663259222 nrkept=74 nrkeptmult=154 
Total energy=-2.95433283141  Egs=-1.78311407078
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9578422478 nrkept=72 nrkeptmult=148 
Total energy=-2.95433302596  Egs=-0.533245316481
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5733000786 nrkept=74 nrkeptmult=154 
Total energy=-2.95433335129  Egs=-1.78348188178
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9643787377 nrkept=72 nrkeptmult=148 
Total energy=-2.95433339992  Egs=-0.533160170964
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5750466162 nrkept=74 nrkeptmult=154 
Total energy=-2.95433348126  Egs=-1.78357389398
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Emax=11.9660147301 nrkept=72 nrkeptmult=148 
Total energy=-2.95433349341  Egs=-0.533138879512
Kept: 72 out of 270, ratio=0.267
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=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5754834377 nrkept=74 nrkeptmult=154 
Total energy=-2.95433351375  Egs=-1.78359690073
Kept: 74 out of 264, ratio=0.28
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=21 min=1 max=41 sum3=176130
Safeguard: keep additional 5 states
Emax=11.9664341779 nrkept=77 nrkeptmult=164 
Total energy=-2.95433351679  Egs=-0.533133556334
Kept: 77 out of 270, ratio=0.285
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=23 min=1 max=39 sum3=226022
Safeguard: keep additional 1 states
Emax=10.5755867064 nrkept=74 nrkeptmult=154 
Total energy=-2.95433352187  Egs=-1.78360265265
Kept: 74 out of 284, ratio=0.261
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=21 min=1 max=41 sum3=176130
Safeguard: keep additional 10 states
Emax=11.9665383715 nrkept=82 nrkeptmult=182 
Total energy=-2.95433352263  Egs=-0.533132225522
Kept: 82 out of 270, ratio=0.304
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=23 min=1 max=40 sum3=253576
Safeguard: keep additional 1 states
Emax=10.5756063656 nrkept=74 nrkeptmult=154 
Total energy=-2.9543335239  Egs=-1.78360409065
Kept: 74 out of 304, ratio=0.243
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=21 min=1 max=41 sum3=176130
Safeguard: keep additional 15 states
Emax=11.9665614173 nrkept=87 nrkeptmult=192 
Total energy=-2.95433352409  Egs=-0.533131892856
Kept: 87 out of 270, ratio=0.322
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=25 min=1 max=42 sum3=287376
Safeguard: keep additional 9 states
Emax=10.5756294628 nrkept=82 nrkeptmult=170 
Total energy=-2.95433352441  Egs=-1.78360445011
Kept: 82 out of 324, ratio=0.253
Memory used: 11 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -2.954333524408099
TKW=0.00072045549758
Grand canonical Z=              4.417042228269742
Zft (last shell)=               4.416871671044884

Memory usage report
===================
  after diag: 11552 kB
after recalc: 11588 kB
 after split: 11580 kB
  after trim: 11588 kB
 after trunc: 11552 kB
      diag_h: 11552 kB

Peak usage: 11588 kB

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