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=	0.0006	 Delta=	0.001	 t=	0.
>> 
>>  Gamma^(1/2)=	0.019544100476116797
>>  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
0.0187978277235 
(-1 2) 2 states
0.00879517480851 0.026952088157 
(0 1) 3 states
0 0.0192584146365 0.0362108722932 
(0 3) 1 states
0.016949435242 
(1 2) 2 states
0.00919865956124 0.027472799645 
(2 1) 1 states
0.0197220239642 
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=2.33960109384 nrkept=35 nrkeptmult=64 
Total energy=-1.26174955751  Egs=-1.13312952358
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=6.25495484305 nrkept=126 nrkeptmult=256 
Total energy=-1.68849473208  Egs=-0.788792572182
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 7 states
Emax=10.3902490548 nrkept=331 nrkeptmult=744 
Total energy=-2.18030574686  Egs=-1.81811956406
Kept: 331 out of 462, ratio=0.716
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=147 sum3=12970382
Safeguard: keep additional 9 states
Emax=10.332631366 nrkept=270 nrkeptmult=600 
Total energy=-2.26813803374  Egs=-0.649394154808
Kept: 270 out of 1232, ratio=0.219
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
Emax=10.599702869 nrkept=263 nrkeptmult=589 
Total energy=-2.37888336566  Egs=-1.63760671111
Kept: 263 out of 1006, ratio=0.261
Memory used: 7 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=6391852
Emax=10.0786601353 nrkept=165 nrkeptmult=340 
Total energy=-2.40128383568  Egs=-0.662477765942
Kept: 165 out of 976, ratio=0.169
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=97 sum3=2223414
Emax=10.0006220766 nrkept=235 nrkeptmult=527 
Total energy=-2.42747550753  Egs=-1.54919965808
Kept: 235 out of 606, ratio=0.388
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=109 sum3=5075678
Emax=10.0468128576 nrkept=157 nrkeptmult=323 
Total energy=-2.43347959953  Egs=-0.710266785047
Kept: 157 out of 878, ratio=0.179
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=93 sum3=1945688
Emax=10.1761555699 nrkept=207 nrkeptmult=468 
Total energy=-2.43968416027  Egs=-1.46796331827
Kept: 207 out of 578, ratio=0.358
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=26 min=1 max=95 sum3=3461722
Emax=10.1819370015 nrkept=151 nrkeptmult=313 
Total energy=-2.44126388414  Egs=-0.747507130139
Kept: 151 out of 772, ratio=0.196
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=89 sum3=1712147
Emax=10.0695457043 nrkept=154 nrkeptmult=351 
Total energy=-2.4427405446  Egs=-1.39747742316
Kept: 154 out of 557, ratio=0.276
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=74 sum3=1485796
Emax=10.005760306 nrkept=100 nrkeptmult=217 
Total energy=-2.44315878287  Egs=-0.791622114579
Kept: 100 out of 574, ratio=0.174
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=20 min=1 max=59 sum3=504419
Emax=10.1012761358 nrkept=118 nrkeptmult=282 
Total energy=-2.44350567156  Egs=-1.31314983878
Kept: 118 out of 371, ratio=0.318
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=25 min=1 max=56 sum3=705050
Emax=10.1263120687 nrkept=87 nrkeptmult=193 
Total energy=-2.44361969757  Egs=-0.863292708715
Kept: 87 out of 446, ratio=0.195
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=19 min=1 max=53 sum3=355921
Emax=10.0462760798 nrkept=116 nrkeptmult=274 
Total energy=-2.44369854626  Egs=-1.19392931426
Kept: 116 out of 325, ratio=0.357
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=25 min=1 max=55 sum3=686784
Emax=10.2192382344 nrkept=87 nrkeptmult=193 
Total energy=-2.44373089989  Egs=-0.97979927945
Kept: 87 out of 438, ratio=0.199
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=19 min=1 max=53 sum3=355921
Emax=10.0171374423 nrkept=111 nrkeptmult=260 
Total energy=-2.44374784208  Egs=-1.02615685788
Kept: 111 out of 325, ratio=0.342
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=24 min=1 max=54 sum3=624274
Emax=10.2130004329 nrkept=87 nrkeptmult=193 
Total energy=-2.44375746694  Egs=-1.16591863855
Kept: 87 out of 418, ratio=0.208
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=20 min=1 max=53 sum3=350857
Emax=10.0642446566 nrkept=103 nrkeptmult=236 
Total energy=-2.44376085299  Egs=-0.820348183615
Kept: 103 out of 325, ratio=0.317
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=24 min=1 max=50 sum3=500408
Emax=10.0334009011 nrkept=80 nrkeptmult=170 
Total energy=-2.44376378505  Egs=-1.42071312521
Kept: 80 out of 386, ratio=0.207
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=20 min=1 max=49 sum3=271658
Emax=10.0088111809 nrkept=89 nrkeptmult=199 
Total energy=-2.44376445575  Egs=-0.649969215977
Kept: 89 out of 296, ratio=0.301
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=23 min=1 max=43 sum3=323424
Emax=10.0666135881 nrkept=79 nrkeptmult=165 
Total energy=-2.44376530221  Egs=-1.64059998551
Kept: 79 out of 330, ratio=0.239
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=46 sum3=235436
Emax=10.1312753662 nrkept=74 nrkeptmult=156 
Total energy=-2.44376544896  Egs=-0.568831871501
Kept: 74 out of 290, ratio=0.255
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=22 min=1 max=38 sum3=206000
Emax=10.1068384335 nrkept=75 nrkeptmult=156 
Total energy=-2.44376567363  Egs=-1.74184182021
Kept: 75 out of 272, ratio=0.276
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=42 sum3=187360
Emax=10.0298900882 nrkept=70 nrkeptmult=143 
Total energy=-2.44376570944  Egs=-0.555164199061
Kept: 70 out of 274, ratio=0.255
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=191855
Emax=10.3591768828 nrkept=73 nrkeptmult=150 
Total energy=-2.44376576581  Egs=-1.74808428384
Kept: 73 out of 257, ratio=0.284
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=173294
Emax=10.0048565979 nrkept=62 nrkeptmult=125 
Total energy=-2.44376577472  Egs=-0.552766403205
Kept: 62 out of 266, ratio=0.233
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=18 min=1 max=36 sum3=145991
Emax=10.4275889005 nrkept=73 nrkeptmult=148 
Total energy=-2.4437657888  Egs=-1.74699086306
Kept: 73 out of 227, ratio=0.322
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=172502
Emax=10.0385524178 nrkept=58 nrkeptmult=115 
Total energy=-2.44376579103  Egs=-0.55214576853
Kept: 58 out of 266, ratio=0.218
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=18 min=1 max=34 sum3=119096
Emax=10.431099063 nrkept=73 nrkeptmult=148 
Total energy=-2.44376579455  Egs=-1.74671350518
Kept: 73 out of 212, ratio=0.344
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=172502
Emax=10.0667126835 nrkept=58 nrkeptmult=115 
Total energy=-2.4437657951  Egs=-0.551989229739
Kept: 58 out of 266, ratio=0.218
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=18 min=1 max=34 sum3=119096
Emax=10.4319784273 nrkept=73 nrkeptmult=148 
Total energy=-2.44376579598  Egs=-1.74664390338
Kept: 73 out of 212, ratio=0.344
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=172502
Emax=10.0738966819 nrkept=58 nrkeptmult=115 
Total energy=-2.44376579612  Egs=-0.551950010518
Kept: 58 out of 266, ratio=0.218
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=18 min=1 max=34 sum3=119096
Emax=10.4321981951 nrkept=73 nrkeptmult=148 
Total energy=-2.44376579634  Egs=-1.74662647772
Kept: 73 out of 212, ratio=0.344
Memory used: 8 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -2.443765796343623
TKW=1.43453058576e-06
Grand canonical Z=               4.41809834257068
Zft (last shell)=               4.417378731092754

Memory usage report
===================
  after diag: 9172 kB
after recalc: 9180 kB
 after split: 9176 kB
  after trim: 9180 kB
 after trunc: 9172 kB
      diag_h: 9172 kB

Peak usage: 9180 kB

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