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=	0.004	 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
0.0247335466753 
(-1 2) 2 states
0.0116304391941 0.0371831487275 
(0 1) 3 states
0 0.0273137111599 0.0514614668689 
(0 3) 1 states
0.0240800412463 
(1 2) 2 states
0.0139144573709 0.0401271739825 
(2 1) 1 states
0.0299615901071 
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=3.06883736907 nrkept=35 nrkeptmult=64 
Total energy=-1.16549296742  Egs=-1.48037992423
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=7.50811333813 nrkept=126 nrkeptmult=256 
Total energy=-1.42954303641  Egs=-0.690232614429
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 1 states
Emax=10.0693472454 nrkept=264 nrkeptmult=592 
Total energy=-1.7575402464  Egs=-1.71478365938
Kept: 264 out of 462, ratio=0.571
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=116 sum3=6408134
Safeguard: keep additional 1 states
Emax=11.4638467107 nrkept=262 nrkeptmult=582 
Total energy=-1.81808064247  Egs=-0.633015640039
Kept: 262 out of 980, ratio=0.267
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=7129712
Emax=10.6102888436 nrkept=263 nrkeptmult=589 
Total energy=-1.89485425117  Egs=-1.60550304274
Kept: 263 out of 974, ratio=0.27
Memory used: 7 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=10.0052071474 nrkept=157 nrkeptmult=323 
Total energy=-1.91150408417  Egs=-0.696368400742
Kept: 157 out of 976, ratio=0.161
Memory used: 7 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=10.3750064336 nrkept=245 nrkeptmult=549 
Total energy=-1.92926676899  Egs=-1.48582540329
Kept: 245 out of 578, ratio=0.424
Memory used: 7 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=10.0656915218 nrkept=157 nrkeptmult=323 
Total energy=-1.93405206192  Egs=-0.800567015988
Kept: 157 out of 913, ratio=0.172
Memory used: 7 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=10.0361779138 nrkept=195 nrkeptmult=440 
Total energy=-1.93799116923  Egs=-1.31800474281
Kept: 195 out of 578, ratio=0.337
Memory used: 7 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=92 sum3=2978995
Emax=10.028972969 nrkept=135 nrkeptmult=281 
Total energy=-1.93941683638  Egs=-0.954041570779
Kept: 135 out of 727, ratio=0.186
Memory used: 7 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=80 sum3=1234103
Emax=10.0478528992 nrkept=148 nrkeptmult=336 
Total energy=-1.94023949484  Egs=-1.10102891004
Kept: 148 out of 497, ratio=0.298
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/33 (scale 0.00037358622311894153) ***** 
[1] xi(11)=1.00000006634 zeta(12)=0
Stats: nr=24 min=2 max=76 sum3=1395139
Emax=10.0719799355 nrkept=111 nrkeptmult=239 
Total energy=-1.94067863565  Egs=-1.17547378103
Kept: 111 out of 553, ratio=0.201
Memory used: 7 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=65 sum3=690022
Emax=10.0345677521 nrkept=119 nrkeptmult=266 
Total energy=-1.94084888023  Egs=-0.911407118769
Kept: 119 out of 412, ratio=0.289
Memory used: 7 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=63 sum3=791747
Emax=10.0449851868 nrkept=91 nrkeptmult=194 
Total energy=-1.94097569515  Egs=-1.35781161611
Kept: 91 out of 443, ratio=0.205
Memory used: 7 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=55 sum3=403129
Emax=10.0248032744 nrkept=95 nrkeptmult=213 
Total energy=-1.94101543372  Egs=-0.850964151605
Kept: 95 out of 337, ratio=0.282
Memory used: 7 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=50 sum3=394644
Emax=10.0050617213 nrkept=76 nrkeptmult=159 
Total energy=-1.94104683761  Egs=-1.34496994036
Kept: 76 out of 354, ratio=0.215
Memory used: 7 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=46 sum3=233056
Emax=10.0835031149 nrkept=73 nrkeptmult=156 
Total energy=-1.94105646816  Egs=-0.824917560258
Kept: 73 out of 280, ratio=0.261
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/33 (scale 5.8372847362334614e-06) ***** 
[1] xi(17)=1.00000000002 zeta(18)=0
Stats: nr=20 min=1 max=41 sum3=200388
Emax=10.0293352855 nrkept=70 nrkeptmult=146 
Total energy=-1.94106426405  Egs=-1.33553389192
Kept: 70 out of 270, ratio=0.259
Memory used: 7 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=41 sum3=172217
Emax=10.1609601148 nrkept=62 nrkeptmult=124 
Total energy=-1.94106664695  Egs=-0.816439213337
Kept: 62 out of 257, ratio=0.241
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/33 (scale 1.4593211840583654e-06) ***** 
[1] xi(19)=1 zeta(20)=0
Stats: nr=19 min=1 max=34 sum3=122243
Emax=10.2950852735 nrkept=68 nrkeptmult=140 
Total energy=-1.94106859122  Egs=-1.33231103744
Kept: 68 out of 227, ratio=0.3
Memory used: 7 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=40 sum3=157563
Emax=10.1532962169 nrkept=60 nrkeptmult=118 
Total energy=-1.94106918525  Egs=-0.814119876535
Kept: 60 out of 249, ratio=0.241
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/33 (scale 3.6483029601459134e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=19 min=1 max=34 sum3=117927
Emax=10.3806889604 nrkept=68 nrkeptmult=139 
Total energy=-1.941069671  Egs=-1.33143160934
Kept: 68 out of 219, ratio=0.311
Memory used: 7 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=41 sum3=164187
Emax=10.0084501325 nrkept=58 nrkeptmult=115 
Total energy=-1.94106981939  Egs=-0.813525198843
Kept: 58 out of 249, ratio=0.233
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/33 (scale 9.1207574003647835e-08) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.3944829124 nrkept=68 nrkeptmult=139 
Total energy=-1.94106994081  Egs=-1.33120593334
Kept: 68 out of 212, ratio=0.321
Memory used: 7 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=164187
Emax=10.0374087754 nrkept=58 nrkeptmult=115 
Total energy=-1.9410699779  Egs=-0.813376236645
Kept: 58 out of 249, ratio=0.233
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/33 (scale 2.2801893500911959e-08) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.0005681118 nrkept=67 nrkeptmult=137 
Total energy=-1.94107000826  Egs=-1.33114871461
Kept: 67 out of 212, ratio=0.316
Memory used: 7 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=40 sum3=155129
Emax=10.0447260837 nrkept=58 nrkeptmult=115 
Total energy=-1.94107001753  Egs=-0.813339277241
Kept: 58 out of 245, ratio=0.237
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/33 (scale 5.7004733752279897e-09) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=19 min=1 max=33 sum3=107240
Emax=10.0011197402 nrkept=67 nrkeptmult=137 
Total energy=-1.94107002512  Egs=-1.33113391922
Kept: 67 out of 212, ratio=0.316
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=40 sum3=155129
Emax=10.0465471064 nrkept=58 nrkeptmult=115 
Total energy=-1.94107002744  Egs=-0.813330388458
Kept: 58 out of 245, ratio=0.237
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=19 min=1 max=33 sum3=107240
Emax=10.0012563049 nrkept=67 nrkeptmult=137 
Total energy=-1.94107002933  Egs=-1.33112975018
Kept: 67 out of 212, ratio=0.316
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=40 sum3=155129
Emax=10.0470050217 nrkept=58 nrkeptmult=115 
Total energy=-1.94107002991  Egs=-0.813328521646
Kept: 58 out of 245, ratio=0.237
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=19 min=1 max=33 sum3=107240
Emax=10.0012890467 nrkept=67 nrkeptmult=137 
Total energy=-1.94107003039  Egs=-1.3311282389
Kept: 67 out of 212, ratio=0.316
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=40 sum3=155129
Emax=10.0471220294 nrkept=58 nrkeptmult=115 
Total energy=-1.94107003053  Egs=-0.81332841065
Kept: 58 out of 245, ratio=0.237
Memory used: 8 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -1.941070030531554
TKW=7.49050387465e-05
Grand canonical Z=              5.446176299947852
Zft (last shell)=               5.444906682938267

Memory usage report
===================
  after diag: 8232 kB
after recalc: 8244 kB
 after split: 8244 kB
  after trim: 8244 kB
 after trunc: 8232 kB
      diag_h: 8232 kB

Peak usage: 8248 kB

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