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=	0.0006	 Delta=	0.0046	 t=	0.
>> 
>>  Gamma^(1/2)=	0.019544100476116797
>>  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
0.0344773598725 
(-1 2) 2 states
0.0162289907056 0.0523560505431 
(0 1) 3 states
0 0.0386655536614 0.0728994528746 
(0 3) 1 states
0.0341076813762 
(1 2) 2 states
0.019944460358 0.0571431863055 
(2 1) 1 states
0.0429799652873 
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=3.5121745129 nrkept=35 nrkeptmult=64 
Total energy=-0.940665742593  Egs=-1.67900672887
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=8.08820318367 nrkept=126 nrkeptmult=256 
Total energy=-1.08670803285  Egs=-0.539886942565
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=10.591108255 nrkept=264 nrkeptmult=592 
Total energy=-1.31117745078  Egs=-1.65963033776
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=6408134
Emax=10.0401212857 nrkept=165 nrkeptmult=340 
Total energy=-1.35449006651  Egs=-0.640469706103
Kept: 165 out of 980, ratio=0.168
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/33 (scale 0.033813165020835083) ***** 
[1] xi(4)=0.999025462085 zeta(5)=0
Stats: nr=23 min=1 max=97 sum3=2209770
Emax=10.0176209968 nrkept=245 nrkeptmult=549 
Total energy=-1.40772180835  Egs=-1.57429042223
Kept: 245 out of 606, ratio=0.404
Memory used: 6 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/33 (scale 0.016906582510417541) ***** 
[1] xi(5)=0.999755986004 zeta(6)=0
Stats: nr=27 min=1 max=112 sum3=5439853
Emax=10.0138239948 nrkept=157 nrkeptmult=323 
Total energy=-1.42006037374  Egs=-0.729808368371
Kept: 157 out of 913, ratio=0.172
Memory used: 7 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=93 sum3=1945688
Emax=10.180057499 nrkept=235 nrkeptmult=526 
Total energy=-1.43212847716  Egs=-1.42762186384
Kept: 235 out of 578, ratio=0.407
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/33 (scale 0.0042266456276043854) ***** 
[1] xi(7)=0.999984741706 zeta(8)=0
Stats: nr=27 min=1 max=109 sum3=4896334
Emax=10.0008146627 nrkept=150 nrkeptmult=310 
Total energy=-1.435844935  Egs=-0.879292508863
Kept: 150 out of 874, ratio=0.172
Memory used: 7 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=89 sum3=1701390
Emax=10.0494764946 nrkept=179 nrkeptmult=396 
Total energy=-1.43847986813  Egs=-1.24681999321
Kept: 179 out of 552, ratio=0.324
Memory used: 7 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=89 sum3=2446944
Emax=10.1676394701 nrkept=122 nrkeptmult=257 
Total energy=-1.43958634149  Egs=-1.04714088165
Kept: 122 out of 666, ratio=0.183
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/33 (scale 0.00052833070345054817) ***** 
[1] xi(10)=0.999999761582 zeta(11)=0
Stats: nr=20 min=1 max=73 sum3=958873
Emax=10.0229893554 nrkept=136 nrkeptmult=307 
Total energy=-1.44017586317  Egs=-1.11581945564
Kept: 136 out of 451, ratio=0.302
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=24 min=1 max=70 sum3=1088818
Emax=10.0222518983 nrkept=99 nrkeptmult=211 
Total energy=-1.44046824306  Egs=-1.10680637045
Kept: 99 out of 508, ratio=0.195
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=20 min=1 max=58 sum3=495696
Emax=10.0554727784 nrkept=103 nrkeptmult=230 
Total energy=-1.44060671245  Egs=-1.04835387892
Kept: 103 out of 366, ratio=0.281
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=24 min=1 max=57 sum3=524088
Emax=10.0624708585 nrkept=78 nrkeptmult=164 
Total energy=-1.44067973526  Egs=-1.10571373888
Kept: 78 out of 384, ratio=0.203
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=20 min=1 max=45 sum3=241242
Emax=10.0625231343 nrkept=74 nrkeptmult=157 
Total energy=-1.44071354524  Egs=-1.02390336724
Kept: 74 out of 288, ratio=0.257
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=20 min=1 max=43 sum3=208755
Emax=10.1295380613 nrkept=68 nrkeptmult=142 
Total energy=-1.44073168732  Egs=-1.0988316389
Kept: 68 out of 273, ratio=0.249
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=20 min=1 max=41 sum3=167344
Emax=10.0356469509 nrkept=62 nrkeptmult=128 
Total energy=-1.44074008288  Egs=-1.01700741484
Kept: 62 out of 250, ratio=0.248
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=20 min=1 max=36 sum3=120318
Emax=10.0366298755 nrkept=62 nrkeptmult=128 
Total energy=-1.4407446074  Egs=-1.0961671611
Kept: 62 out of 228, ratio=0.272
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=20 min=1 max=36 sum3=120318
Emax=10.2320618368 nrkept=61 nrkeptmult=125 
Total energy=-1.44074670264  Egs=-1.01523611994
Kept: 61 out of 228, ratio=0.268
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=20 min=1 max=35 sum3=113342
Emax=10.1414351493 nrkept=61 nrkeptmult=125 
Total energy=-1.440747833  Egs=-1.0954219807
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3067382103 nrkept=61 nrkeptmult=125 
Total energy=-1.44074835658  Egs=-1.01479062285
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.1785358657 nrkept=61 nrkeptmult=125 
Total energy=-1.44074863912  Egs=-1.09523020796
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3258532129 nrkept=61 nrkeptmult=125 
Total energy=-1.44074877  Egs=-1.01467912141
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.1878509652 nrkept=61 nrkeptmult=125 
Total energy=-1.44074884063  Egs=-1.09518187767
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3306607065 nrkept=61 nrkeptmult=125 
Total energy=-1.44074887335  Egs=-1.01465127263
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.1901823759 nrkept=61 nrkeptmult=125 
Total energy=-1.44074889101  Egs=-1.09516973388
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3318643709 nrkept=61 nrkeptmult=125 
Total energy=-1.44074889919  Egs=-1.0146443472
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.190765476 nrkept=61 nrkeptmult=125 
Total energy=-1.44074890361  Egs=-1.09516665723
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3321653441 nrkept=61 nrkeptmult=125 
Total energy=-1.44074890565  Egs=-1.01464265341
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.1909113316 nrkept=61 nrkeptmult=125 
Total energy=-1.44074890675  Egs=-1.09516584865
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3322405264 nrkept=61 nrkeptmult=125 
Total energy=-1.44074890727  Egs=-1.01464226763
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.1909478611 nrkept=61 nrkeptmult=125 
Total energy=-1.44074890754  Egs=-1.09516560717
Kept: 61 out of 224, ratio=0.272
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=20 min=1 max=35 sum3=113342
Emax=10.3322592514 nrkept=61 nrkeptmult=125 
Total energy=-1.44074890767  Egs=-1.01464220886
Kept: 61 out of 224, ratio=0.272
Memory used: 7 MB  Time elapsed: 0 s

** Iteration completed.


Total energy:             -1.440748907668882
TKW=0.000208967079144
Grand canonical Z=              4.975053545315176
Zft (last shell)=                4.97407430439658

Memory usage report
===================
  after diag: 7956 kB
after recalc: 7968 kB
 after split: 7964 kB
  after trim: 7968 kB
 after trunc: 7956 kB
      diag_h: 7956 kB

Peak usage: 7972 kB

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