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=1.25963855612e-10
Nmax=33
Tmin=1e-10
Ninit=0
Lambda=4
strategy=kept
lastall=0
lastalloverride=0
z=1
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=	0.00095493	 Delta=	0	 t=	0.
>> 
>>  Gamma^(1/2)=	0.02465618217054243
>>  Lambda=	4.	 BAND=	flat
>>  DISCRETIZATION=	Z	 z=	1.
>>  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=1
# keep=5000 keepenergy=10 Nmax=33 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.0479433224939 
(-1 2) 2 states
0.0227288450832 0.0685368187009 
(0 1) 3 states
0 0.0479433224939 0.0912656637841 
(0 3) 1 states
0.0433223412902 
(1 2) 2 states
0.0227288450832 0.0685368187009 
(2 1) 1 states
0.0479433224939 
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 0.54101064033336133) ***** 
[1] xi(0)=0.872871560944 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=3.50543435014 nrkept=35 nrkeptmult=64 
Total energy=-0.945738641208  Egs=-1.66145151129
Kept: 35 out of 35, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/33 (scale 0.27050532016668066) ***** 
[1] xi(1)=0.945372903138 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=8.12205573405 nrkept=126 nrkeptmult=256 
Total energy=-1.09602964338  Egs=-0.555593516887
Kept: 126 out of 126, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/33 (scale 0.13525266008334033) ***** 
[1] xi(2)=0.984886060978 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Safeguard: keep additional 1 states
Emax=10.5987910196 nrkept=264 nrkeptmult=594 
Total energy=-1.31654890187  Egs=-1.63042455768
Kept: 264 out of 462, ratio=0.571
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/33 (scale 0.067626330041670166) ***** 
[1] xi(3)=0.996126049722 zeta(4)=0
Stats: nr=28 min=1 max=116 sum3=6400760
Safeguard: keep additional 1 states
Emax=10.078360505 nrkept=166 nrkeptmult=344 
Total energy=-1.36141868594  Egs=-0.663495772164
Kept: 166 out of 980, ratio=0.169
Memory used: 5 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/33 (scale 0.033813165020835083) ***** 
[1] xi(4)=0.999025462085 zeta(5)=0
Stats: nr=21 min=1 max=97 sum3=2238520
Safeguard: keep additional 1 states
Emax=10.655102076 nrkept=264 nrkeptmult=594 
Total energy=-1.41332849739  Egs=-1.5351952832
Kept: 264 out of 610, ratio=0.433
Memory used: 5 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/33 (scale 0.016906582510417541) ***** 
[1] xi(5)=0.999755986004 zeta(6)=0
Stats: nr=28 min=1 max=116 sum3=6400760
Emax=10.0343559594 nrkept=157 nrkeptmult=323 
Total energy=-1.42586956662  Egs=-0.741786178456
Kept: 157 out of 980, ratio=0.16
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/33 (scale 0.0084532912552087707) ***** 
[1] xi(6)=0.99993897276 zeta(7)=0
Stats: nr=21 min=1 max=94 sum3=1975880
Safeguard: keep additional 2 states
Emax=10.0060666404 nrkept=209 nrkeptmult=476 
Total energy=-1.43782283094  Egs=-1.41403672956
Kept: 209 out of 578, ratio=0.362
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/33 (scale 0.0042266456276043854) ***** 
[1] xi(7)=0.999984741706 zeta(8)=0
Stats: nr=26 min=1 max=95 sum3=3507342
Emax=10.1886379822 nrkept=157 nrkeptmult=323 
Total energy=-1.44126754895  Egs=-0.815000431728
Kept: 157 out of 780, ratio=0.201
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/33 (scale 0.0021133228138021927) ***** 
[1] xi(8)=0.999996185334 zeta(9)=0
Stats: nr=21 min=1 max=94 sum3=1975880
Emax=10.1178424632 nrkept=181 nrkeptmult=406 
Total energy=-1.44399926615  Egs=-1.29261709483
Kept: 181 out of 578, ratio=0.313
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/33 (scale 0.0010566614069010963) ***** 
[1] xi(9)=0.999999046328 zeta(10)=0
Stats: nr=25 min=1 max=85 sum3=2477276
Safeguard: keep additional 1 states
Emax=10.057927882 nrkept=120 nrkeptmult=252 
Total energy=-1.44494547044  Egs=-0.895465930624
Kept: 120 out of 674, ratio=0.178
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/33 (scale 0.00052833070345054817) ***** 
[1] xi(10)=0.999999761582 zeta(11)=0
Stats: nr=21 min=1 max=71 sum3=862792
Emax=10.0551818991 nrkept=127 nrkeptmult=292 
Total energy=-1.44555538135  Egs=-1.15441125408
Kept: 127 out of 442, ratio=0.287
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/33 (scale 0.00026416535172527408) ***** 
[1] xi(11)=0.999999940395 zeta(12)=0
Stats: nr=25 min=1 max=60 sum3=870392
Safeguard: keep additional 2 states
Emax=10.1038967699 nrkept=89 nrkeptmult=195 
Total energy=-1.44582600463  Egs=-1.02444653888
Kept: 89 out of 476, ratio=0.187
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/33 (scale 0.00013208267586263704) ***** 
[1] xi(12)=0.999999985099 zeta(13)=0
Stats: nr=19 min=1 max=54 sum3=376099
Safeguard: keep additional 1 states
Emax=10.0885027093 nrkept=113 nrkeptmult=264 
Total energy=-1.44595438984  Egs=-0.972006427436
Kept: 113 out of 331, ratio=0.341
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 14/33 (scale 6.6041337931318521e-05) ***** 
[1] xi(13)=0.999999996275 zeta(14)=0
Stats: nr=25 min=1 max=54 sum3=637704
Safeguard: keep additional 4 states
Emax=10.2425330914 nrkept=91 nrkeptmult=197 
Total energy=-1.44603569995  Egs=-1.23120029775
Kept: 91 out of 426, ratio=0.214
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 15/33 (scale 3.3020668965659261e-05) ***** 
[1] xi(14)=0.999999999069 zeta(15)=0
Stats: nr=21 min=1 max=54 sum3=376573
Emax=10.0351090239 nrkept=101 nrkeptmult=232 
Total energy=-1.44606099444  Egs=-0.766019869459
Kept: 101 out of 337, ratio=0.3
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 16/33 (scale 1.651033448282963e-05) ***** 
[1] xi(15)=0.999999999767 zeta(16)=0
Stats: nr=23 min=1 max=49 sum3=488814
Emax=10.0284376076 nrkept=78 nrkeptmult=168 
Total energy=-1.44608560563  Egs=-1.49065370632
Kept: 78 out of 378, ratio=0.206
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 17/33 (scale 8.2551672414148151e-06) ***** 
[1] xi(16)=0.999999999942 zeta(17)=0
Stats: nr=19 min=1 max=49 sum3=266660
Safeguard: keep additional 2 states
Emax=10.3682812646 nrkept=90 nrkeptmult=198 
Total energy=-1.44609071756  Egs=-0.619240202739
Kept: 90 out of 290, ratio=0.31
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 18/33 (scale 4.1275836207074076e-06) ***** 
[1] xi(17)=0.999999999985 zeta(18)=0
Stats: nr=23 min=1 max=45 sum3=353050
Emax=10.1675645905 nrkept=79 nrkeptmult=165 
Total energy=-1.44609764849  Egs=-1.67917384481
Kept: 79 out of 334, ratio=0.237
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 19/33 (scale 2.0637918103537038e-06) ***** 
[1] xi(18)=0.999999999996 zeta(19)=0
Stats: nr=21 min=1 max=46 sum3=235436
Emax=10.438298178 nrkept=72 nrkeptmult=148 
Total energy=-1.44609880019  Egs=-0.558048426535
Kept: 72 out of 290, ratio=0.248
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 20/33 (scale 1.0318959051768519e-06) ***** 
[1] xi(19)=0.999999999999 zeta(20)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.077689685 nrkept=74 nrkeptmult=154 
Total energy=-1.44610061051  Egs=-1.75436413991
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 21/33 (scale 5.1594795258842595e-07) ***** 
[1] xi(20)=1 zeta(21)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.4863918424 nrkept=72 nrkeptmult=148 
Total energy=-1.44610088894  Egs=-0.539640503019
Kept: 72 out of 270, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 22/33 (scale 2.5797397629421297e-07) ***** 
[1] xi(21)=1 zeta(22)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.4393779468 nrkept=74 nrkeptmult=154 
Total energy=-1.44610134712  Egs=-1.77606946981
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 23/33 (scale 1.2898698814710649e-07) ***** 
[1] xi(22)=1 zeta(23)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.8394802455 nrkept=72 nrkeptmult=148 
Total energy=-1.4461014161  Egs=-0.53477811151
Kept: 72 out of 270, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 24/33 (scale 6.4493494073553243e-08) ***** 
[1] xi(23)=1 zeta(24)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5408130083 nrkept=74 nrkeptmult=154 
Total energy=-1.446101531  Egs=-1.78170621417
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 25/33 (scale 3.2246747036776622e-08) ***** 
[1] xi(24)=1 zeta(25)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9343504557 nrkept=72 nrkeptmult=148 
Total energy=-1.44610154821  Egs=-0.533544591784
Kept: 72 out of 270, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 26/33 (scale 1.6123373518388311e-08) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.566877997 nrkept=74 nrkeptmult=154 
Total energy=-1.44610157696  Egs=-1.78312906162
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 27/33 (scale 8.0616867591941554e-09) ***** 
[1] xi(26)=1 zeta(27)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9584804195 nrkept=72 nrkeptmult=148 
Total energy=-1.44610158126  Egs=-0.533235061555
Kept: 72 out of 270, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 28/33 (scale 4.0308433795970777e-09) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5734383577 nrkept=74 nrkeptmult=154 
Total energy=-1.44610158845  Egs=-1.78348563537
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 29/33 (scale 2.0154216897985389e-09) ***** 
[1] xi(28)=1 zeta(29)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9645385681 nrkept=72 nrkeptmult=148 
Total energy=-1.44610158952  Egs=-0.533157606644
Kept: 72 out of 270, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 30/33 (scale 1.0077108448992694e-09) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5750812023 nrkept=74 nrkeptmult=154 
Total energy=-1.44610159132  Egs=-1.78357483274
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 31/33 (scale 5.0385542244963471e-10) ***** 
[1] xi(30)=1 zeta(31)=0
Stats: nr=21 min=1 max=41 sum3=176130
Emax=11.9660547057 nrkept=72 nrkeptmult=148 
Total energy=-1.44610159159  Egs=-0.533138238395
Kept: 72 out of 270, ratio=0.267
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 32/33 (scale 2.5192771122481736e-10) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=21 min=1 max=37 sum3=196806
Safeguard: keep additional 1 states
Emax=10.5754920853 nrkept=74 nrkeptmult=154 
Total energy=-1.44610159204  Egs=-1.78359713545
Kept: 74 out of 264, ratio=0.28
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 33/33 (scale 1.2596385561240868e-10) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=21 min=1 max=41 sum3=176130
Safeguard: keep additional 5 states
Emax=11.9664450599 nrkept=77 nrkeptmult=164 
Total energy=-1.4461015921  Egs=-0.533133396052
Kept: 77 out of 270, ratio=0.285
Memory used: 7 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -1.446101592103356
TKW=1.96827110126e-05
Grand canonical Z=              6.708531687492717
Zft (last shell)=               6.707989112527766

Memory usage report
===================
  after diag: 7400 kB
after recalc: 7412 kB
 after split: 7408 kB
  after trim: 7412 kB
 after trunc: 7400 kB
      diag_h: 7400 kB

Peak usage: 7412 kB

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