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=43
TEMPERATURE T=1.3223879413e-10
Nmax=43
Tmin=1e-10
Ninit=0
Lambda=3
strategy=kept
lastall=0
lastalloverride=0
z=0.25
discretization=Z
band=flat
betabar=1
T=1.3223879413e-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	 t=	0.
>> 
>>  Gamma^(1/2)=	0.019544100476116797
>>  Lambda=	3.	 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=3 z=0.25
# keep=5000 keepenergy=10 Nmax=43 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.017391518158 
(-1 2) 2 states
0.00812423186645 0.0245718923955 
(0 1) 3 states
0 0.017391518158 0.032696124262 
(0 3) 1 states
0.015304606104 
(1 2) 2 states
0.00812423186645 0.0245718923955 
(2 1) 1 states
0.017391518158 
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 1/43 (scale 1.3832644937419567) ***** 
[1] xi(0)=0.419770954375 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=1.6836412064 nrkept=35 nrkeptmult=64 
Total energy=-1.16196055051  Egs=-0.813504928985
Kept: 35 out of 35, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/43 (scale 0.79862812782237003) ***** 
[1] xi(1)=0.749224547529 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=4.24712069469 nrkept=126 nrkeptmult=256 
Total energy=-1.69343502452  Egs=-0.665484291741
Kept: 126 out of 126, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/43 (scale 0.46108816458065222) ***** 
[1] xi(2)=1.25250020132 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Safeguard: keep additional 1 states
Emax=10.5471784915 nrkept=453 nrkeptmult=1010 
Total energy=-2.60808779569  Egs=-1.98368303815
Kept: 453 out of 462, ratio=0.981
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/43 (scale 0.26620937594079003) ***** 
[1] xi(3)=1.24631181837 zeta(4)=0
Stats: nr=28 min=1 max=204 sum3=34462150
Safeguard: keep additional 1 states
Emax=10.3875771176 nrkept=716 nrkeptmult=1700 
Total energy=-2.85030134484  Egs=-0.909861075681
Kept: 716 out of 1684, ratio=0.425
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/43 (scale 0.1536960548602174) ***** 
[1] xi(4)=1.06045468118 zeta(5)=0
Stats: nr=33 min=2 max=334 sum3=112846582
Safeguard: keep additional 3 states
Emax=10.1000934357 nrkept=495 nrkeptmult=1124 
Total energy=-3.10467737765  Egs=-1.65505896063
Kept: 495 out of 2686, ratio=0.184
Memory used: 13 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/43 (scale 0.088736458646930014) ***** 
[1] xi(5)=1.01240866565 zeta(6)=0
Stats: nr=32 min=1 max=219 sum3=43262606
Safeguard: keep additional 6 states
Emax=10.291492358 nrkept=419 nrkeptmult=975 
Total energy=-3.16932662896  Egs=-0.728553429915
Kept: 419 out of 1844, ratio=0.227
Memory used: 14 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/43 (scale 0.051232018286739137) ***** 
[1] xi(6)=1.00352829264 zeta(7)=0
Stats: nr=33 min=1 max=204 sum3=24528289
Safeguard: keep additional 1 states
Emax=10.6172150617 nrkept=389 nrkeptmult=874 
Total energy=-3.25007116462  Egs=-1.57605611429
Kept: 389 out of 1567, ratio=0.248
Memory used: 15 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/43 (scale 0.029578819548976672) ***** 
[1] xi(7)=1.00113318518 zeta(8)=0
Stats: nr=28 min=1 max=173 sum3=21206352
Safeguard: keep additional 3 states
Emax=10.3138928599 nrkept=416 nrkeptmult=972 
Total energy=-3.27242784332  Egs=-0.755834040473
Kept: 416 out of 1446, ratio=0.288
Memory used: 14 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/43 (scale 0.017077339428913048) ***** 
[1] xi(8)=1.00037363698 zeta(9)=0
Stats: nr=33 min=1 max=203 sum3=24107488
Safeguard: keep additional 1 states
Emax=10.0675966713 nrkept=357 nrkeptmult=806 
Total energy=-3.29835154668  Egs=-1.51801769096
Kept: 357 out of 1558, ratio=0.229
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 10/43 (scale 0.0098596065163255569) ***** 
[1] xi(9)=1.00012410789 zeta(10)=0
Stats: nr=28 min=1 max=162 sum3=17066972
Emax=10.3801724394 nrkept=413 nrkeptmult=963 
Total energy=-3.30613227658  Egs=-0.789152172026
Kept: 413 out of 1334, ratio=0.31
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 11/43 (scale 0.0056924464763043487) ***** 
[1] xi(10)=1.0000413212 zeta(11)=0
Stats: nr=33 min=1 max=202 sum3=23580328
Emax=10.1706633831 nrkept=340 nrkeptmult=774 
Total energy=-3.3144839554  Egs=-1.46715104875
Kept: 340 out of 1546, ratio=0.22
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 12/43 (scale 0.0032865355054418526) ***** 
[1] xi(11)=1.00001376841 zeta(12)=0
Stats: nr=28 min=1 max=153 sum3=14512518
Emax=10.0018632559 nrkept=347 nrkeptmult=797 
Total energy=-3.31716190483  Egs=-0.814824432108
Kept: 347 out of 1272, ratio=0.273
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 13/43 (scale 0.0018974821587681161) ***** 
[1] xi(12)=1.00000458888 zeta(13)=0
Stats: nr=31 min=1 max=176 sum3=15122974
Safeguard: keep additional 1 states
Emax=10.044210514 nrkept=281 nrkeptmult=642 
Total energy=-3.31986479093  Egs=-1.42445929613
Kept: 281 out of 1294, ratio=0.217
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 14/43 (scale 0.001095511835147284) ***** 
[1] xi(13)=1.00000152956 zeta(14)=0
Stats: nr=26 min=1 max=127 sum3=8460042
Emax=10.2865845511 nrkept=271 nrkeptmult=633 
Total energy=-3.32078601334  Egs=-0.840905939617
Kept: 271 out of 1050, ratio=0.258
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 15/43 (scale 0.00063249405292270544) ***** 
[1] xi(14)=1.00000050985 zeta(15)=0
Stats: nr=31 min=1 max=140 sum3=7432085
Safeguard: keep additional 1 states
Emax=10.0362264317 nrkept=195 nrkeptmult=456 
Total energy=-3.32165787848  Egs=-1.3784558851
Kept: 195 out of 1013, ratio=0.192
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 16/43 (scale 0.00036517061171576138) ***** 
[1] xi(15)=1.00000016995 zeta(16)=0
Stats: nr=26 min=1 max=91 sum3=3081456
Safeguard: keep additional 2 states
Emax=10.2809892897 nrkept=213 nrkeptmult=523 
Total energy=-3.32197845896  Egs=-0.877892322183
Kept: 213 out of 732, ratio=0.291
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 17/43 (scale 0.00021083135097423514) ***** 
[1] xi(16)=1.00000005665 zeta(17)=0
Stats: nr=31 min=1 max=108 sum3=3544234
Emax=10.0235521445 nrkept=179 nrkeptmult=428 
Total energy=-3.32225651762  Egs=-1.31886768135
Kept: 179 out of 802, ratio=0.223
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 18/43 (scale 0.00012172353723858711) ***** 
[1] xi(17)=1.00000001888 zeta(18)=0
Stats: nr=26 min=1 max=82 sum3=2333108
Safeguard: keep additional 2 states
Emax=10.4486725302 nrkept=213 nrkeptmult=523 
Total energy=-3.3223699192  Egs=-0.931632346601
Kept: 213 out of 674, ratio=0.316
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 19/43 (scale 7.0277116991411708e-05) ***** 
[1] xi(18)=1.00000000629 zeta(19)=0
Stats: nr=31 min=1 max=108 sum3=3544234
Safeguard: keep additional 2 states
Emax=10.0840374601 nrkept=178 nrkeptmult=424 
Total energy=-3.32245699126  Egs=-1.23898167784
Kept: 178 out of 802, ratio=0.222
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 20/43 (scale 4.0574512412862373e-05) ***** 
[1] xi(19)=1.0000000021 zeta(20)=0
Stats: nr=26 min=1 max=82 sum3=2302678
Emax=10.016578919 nrkept=208 nrkeptmult=516 
Total energy=-3.32249794212  Egs=-1.00927546453
Kept: 208 out of 670, ratio=0.31
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 21/43 (scale 2.3425705663803904e-05) ***** 
[1] xi(20)=1.0000000007 zeta(21)=0
Stats: nr=31 min=1 max=105 sum3=3290513
Safeguard: keep additional 1 states
Emax=10.0775615457 nrkept=177 nrkeptmult=414 
Total energy=-3.32252446909  Egs=-1.13238719475
Kept: 177 out of 785, ratio=0.225
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 22/43 (scale 1.3524837470954124e-05) ***** 
[1] xi(21)=1.00000000023 zeta(22)=0
Stats: nr=26 min=1 max=83 sum3=2328838
Emax=10.0548582408 nrkept=205 nrkeptmult=501 
Total energy=-3.32253963421  Egs=-1.12127942598
Kept: 205 out of 664, ratio=0.309
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 23/43 (scale 7.8085685546013012e-06) ***** 
[1] xi(22)=1.00000000008 zeta(23)=0
Stats: nr=29 min=1 max=104 sum3=3207713
Safeguard: keep additional 2 states
Emax=10.0143477525 nrkept=175 nrkeptmult=412 
Total energy=-3.32254741954  Egs=-0.99702413412
Kept: 175 out of 773, ratio=0.226
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 24/43 (scale 4.5082791569847079e-06) ***** 
[1] xi(23)=1.00000000003 zeta(24)=0
Stats: nr=26 min=1 max=82 sum3=2253868
Emax=10.0264670779 nrkept=183 nrkeptmult=425 
Total energy=-3.32255316825  Egs=-1.27514372227
Kept: 183 out of 658, ratio=0.278
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 25/43 (scale 2.6028561848671004e-06) ***** 
[1] xi(24)=1.00000000001 zeta(25)=0
Stats: nr=27 min=1 max=98 sum3=2540408
Emax=10.0716151266 nrkept=169 nrkeptmult=396 
Total energy=-3.32255538101  Egs=-0.850127133723
Kept: 169 out of 686, ratio=0.246
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 26/43 (scale 1.5027597189949027e-06) ***** 
[1] xi(25)=1 zeta(26)=0
Stats: nr=26 min=1 max=79 sum3=2005426
Emax=10.050160889 nrkept=165 nrkeptmult=375 
Total energy=-3.32255756364  Egs=-1.45241846051
Kept: 165 out of 634, ratio=0.26
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 27/43 (scale 8.676187282890334e-07) ***** 
[1] xi(26)=1 zeta(27)=0
Stats: nr=27 min=1 max=90 sum3=1890417
Safeguard: keep additional 1 states
Emax=10.0705437081 nrkept=161 nrkeptmult=370 
Total energy=-3.32255820009  Egs=-0.733558691838
Kept: 161 out of 615, ratio=0.262
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 28/43 (scale 5.009199063316343e-07) ***** 
[1] xi(27)=1 zeta(28)=0
Stats: nr=25 min=1 max=75 sum3=1749488
Safeguard: keep additional 3 states
Emax=10.0404862762 nrkept=142 nrkeptmult=304 
Total energy=-3.3225589995  Egs=-1.59587499782
Kept: 142 out of 602, ratio=0.236
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 29/43 (scale 2.8920624276301115e-07) ***** 
[1] xi(28)=1 zeta(29)=0
Stats: nr=21 min=1 max=81 sum3=1334002
Safeguard: keep additional 2 states
Emax=10.0710900834 nrkept=148 nrkeptmult=324 
Total energy=-3.32255919323  Egs=-0.669889165153
Kept: 148 out of 526, ratio=0.281
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 30/43 (scale 1.6697330211054477e-07) ***** 
[1] xi(29)=1 zeta(30)=0
Stats: nr=25 min=1 max=71 sum3=1411012
Safeguard: keep additional 1 states
Emax=10.0466441486 nrkept=119 nrkeptmult=247 
Total energy=-3.32255947255  Egs=-1.67283539302
Kept: 119 out of 550, ratio=0.216
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 31/43 (scale 9.6402080921003717e-08) ***** 
[1] xi(30)=1 zeta(31)=0
Stats: nr=21 min=1 max=70 sum3=829177
Emax=10.0069908417 nrkept=129 nrkeptmult=288 
Total energy=-3.32255953457  Egs=-0.643331662434
Kept: 129 out of 439, ratio=0.294
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 32/43 (scale 5.5657767370181585e-08) ***** 
[1] xi(31)=1 zeta(32)=0
Stats: nr=25 min=1 max=62 sum3=968502
Safeguard: keep additional 1 states
Emax=10.0249510999 nrkept=108 nrkeptmult=220 
Total energy=-3.32255962942  Egs=-1.70407568981
Kept: 108 out of 480, ratio=0.225
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 33/43 (scale 3.213402697366791e-08) ***** 
[1] xi(32)=1 zeta(33)=0
Stats: nr=21 min=1 max=63 sum3=612299
Emax=10.0680153872 nrkept=112 nrkeptmult=244 
Total energy=-3.32255964978  Egs=-0.633664540128
Kept: 112 out of 395, ratio=0.284
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 34/43 (scale 1.8552589123393859e-08) ***** 
[1] xi(33)=1 zeta(34)=0
Stats: nr=25 min=1 max=54 sum3=614330
Safeguard: keep additional 1 states
Emax=10.3932562297 nrkept=108 nrkeptmult=220 
Total energy=-3.3225596816  Egs=-1.71525449226
Kept: 108 out of 416, ratio=0.26
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 35/43 (scale 1.0711342324555969e-08) ***** 
[1] xi(34)=1 zeta(35)=0
Stats: nr=21 min=1 max=63 sum3=612299
Emax=10.2146125548 nrkept=112 nrkeptmult=244 
Total energy=-3.32255968835  Egs=-0.630338499593
Kept: 112 out of 395, ratio=0.284
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 36/43 (scale 6.1841963744646209e-09) ***** 
[1] xi(35)=1 zeta(36)=0
Stats: nr=25 min=1 max=54 sum3=614330
Safeguard: keep additional 1 states
Emax=10.5295849052 nrkept=108 nrkeptmult=220 
Total energy=-3.32255969898  Egs=-1.71907218573
Kept: 108 out of 416, ratio=0.26
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 37/43 (scale 3.5704474415186564e-09) ***** 
[1] xi(36)=1 zeta(37)=0
Stats: nr=21 min=1 max=63 sum3=612299
Emax=10.2605328629 nrkept=112 nrkeptmult=244 
Total energy=-3.32255970123  Egs=-0.629217694682
Kept: 112 out of 395, ratio=0.284
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 38/43 (scale 2.0613987914882068e-09) ***** 
[1] xi(37)=1 zeta(38)=0
Stats: nr=25 min=1 max=54 sum3=614330
Safeguard: keep additional 1 states
Emax=10.5761373596 nrkept=108 nrkeptmult=220 
Total energy=-3.32255970478  Egs=-1.72035515767
Kept: 108 out of 416, ratio=0.26
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 39/43 (scale 1.1901491471728853e-09) ***** 
[1] xi(38)=1 zeta(39)=0
Stats: nr=21 min=1 max=63 sum3=612299
Emax=10.2757591404 nrkept=112 nrkeptmult=244 
Total energy=-3.32255970552  Egs=-0.62884272218
Kept: 112 out of 395, ratio=0.284
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 40/43 (scale 6.8713293049606891e-10) ***** 
[1] xi(39)=1 zeta(40)=0
Stats: nr=25 min=1 max=54 sum3=614330
Safeguard: keep additional 3 states
Emax=10.589717081 nrkept=110 nrkeptmult=228 
Total energy=-3.32255970671  Egs=-1.72078397861
Kept: 110 out of 416, ratio=0.264
Memory used: 17 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 41/43 (scale 3.9671638239096179e-10) ***** 
[1] xi(40)=1 zeta(41)=0
Stats: nr=21 min=1 max=63 sum3=625231
Emax=10.2808281191 nrkept=112 nrkeptmult=244 
Total energy=-3.32255970696  Egs=-0.628717577991
Kept: 112 out of 403, ratio=0.278
Memory used: 17 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 42/43 (scale 2.2904431016535628e-10) ***** 
[1] xi(41)=1 zeta(42)=0
Stats: nr=25 min=1 max=54 sum3=614330
Safeguard: keep additional 1 states
Emax=10.5918181287 nrkept=108 nrkeptmult=224 
Total energy=-3.32255970735  Egs=-1.72092703603
Kept: 108 out of 416, ratio=0.26
Memory used: 17 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 43/43 (scale 1.3223879413032059e-10) ***** 
[1] xi(42)=1 zeta(43)=0
Stats: nr=21 min=1 max=61 sum3=575735
Emax=10.2825182702 nrkept=112 nrkeptmult=244 
Total energy=-3.32255970743  Egs=-0.628675845744
Kept: 112 out of 395, ratio=0.284
Memory used: 17 MB  Time elapsed: 2 s

** Iteration completed.


Total energy:             -3.322559707433049
TKW=1.19944765866e-06
Grand canonical Z=              8.021976780648629
Zft (last shell)=               8.018366229146984

Memory usage report
===================
  after diag: 17696 kB
after recalc: 17708 kB
 after split: 17996 kB
  after trim: 17708 kB
 after trunc: 17696 kB
      diag_h: 17696 kB

Peak usage: 17996 kB

Timing report
=============
         All: 2 s
        diag: 1 s
    recalc f: 0 s
       Other: 0 s
