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=66
TEMPERATURE T=1.18759861984e-10
Nmax=66
Tmin=1e-10
Ninit=0
Lambda=2
strategy=kept
lastall=0
lastalloverride=0
z=1
discretization=Z
band=flat
betabar=1
T=1.18759861984e-10
T_ratio=1
Tmin_ratio=-999
keep=5000
keepenergy=8
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=20
dumpscaled=1
dumpabs=0
dumpprecision=8
dumpgroups=0
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=	2.	 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=2 z=1
# keep=5000 keepenergy=8 Nmax=66 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.0398762143646 
(-1 2) 2 states
0.0186573832465 0.0571740129088 
(0 1) 3 states
0 0.0408532667532 0.0768148600535 
(0 3) 1 states
0.0359551817907 
(1 2) 2 states
0.0195133036607 0.0582786087814 
(2 1) 1 states
0.0418367306515 
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 1/66 (scale 0.72134752044448169) ***** 
[1] xi(0)=0.755928946018 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=3.03395576134 nrkept=35 nrkeptmult=64 
Total energy=-1.09026886272  Egs=-1.46197156512
Kept: 35 out of 35, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/66 (scale 0.51006972329839473) ***** 
[1] xi(1)=0.814613079963 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=5.47102277557 nrkept=126 nrkeptmult=256 
Total energy=-1.39179709723  Egs=-0.591151014738
Kept: 126 out of 126, ratio=1
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/66 (scale 0.36067376022224085) ***** 
[1] xi(2)=0.892494029723 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Safeguard: keep additional 7 states
Emax=8.00254377153 nrkept=402 nrkeptmult=908 
Total energy=-1.92319060947  Egs=-1.4733356591
Kept: 402 out of 462, ratio=0.87
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/66 (scale 0.25503486164919736) ***** 
[1] xi(3)=0.942104180991 zeta(4)=0
Stats: nr=28 min=1 max=178 sum3=23124154
Safeguard: keep additional 1 states
Emax=8.06694712774 nrkept=716 nrkeptmult=1700 
Total energy=-2.12329838017  Egs=-0.784629087204
Kept: 716 out of 1498, ratio=0.478
Memory used: 8 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/66 (scale 0.18033688011112042) ***** 
[1] xi(4)=0.96993426226 zeta(5)=0
Stats: nr=33 min=2 max=334 sum3=112846582
Emax=8.00359446951 nrkept=915 nrkeptmult=2200 
Total energy=-2.395259059  Egs=-1.50807022207
Kept: 915 out of 2686, ratio=0.341
Memory used: 13 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/66 (scale 0.12751743082459868) ***** 
[1] xi(5)=0.984675515632 zeta(6)=0
Stats: nr=38 min=1 max=375 sum3=228799886
Emax=8.03198329558 nrkept=849 nrkeptmult=2018 
Total energy=-2.50400151692  Egs=-0.85276543928
Kept: 849 out of 3434, ratio=0.247
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 7/66 (scale 0.090168440055560212) ***** 
[1] xi(6)=0.992263204714 zeta(7)=0
Stats: nr=33 min=2 max=397 sum3=190001532
Emax=8.0042565374 nrkept=871 nrkeptmult=2086 
Total energy=-2.6394802422  Egs=-1.50250714326
Kept: 871 out of 3186, ratio=0.273
Memory used: 16 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 8/66 (scale 0.063758715412299341) ***** 
[1] xi(7)=0.996112749408 zeta(8)=0
Stats: nr=38 min=1 max=354 sum3=196594548
Emax=8.02932179624 nrkept=849 nrkeptmult=2018 
Total energy=-2.6959044319  Egs=-0.884964343181
Kept: 849 out of 3258, ratio=0.261
Memory used: 18 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 9/66 (scale 0.045084220027780106) ***** 
[1] xi(8)=0.998051634085 zeta(9)=0
Stats: nr=33 min=2 max=397 sum3=190001532
Emax=8.00427092791 nrkept=853 nrkeptmult=2051 
Total energy=-2.76272926239  Egs=-1.48222217088
Kept: 853 out of 3186, ratio=0.268
Memory used: 20 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 10/66 (scale 0.031879357706149671) ***** 
[1] xi(9)=0.99902462843 zeta(10)=0
Stats: nr=38 min=1 max=347 sum3=184868031
Emax=8.04126111374 nrkept=849 nrkeptmult=2018 
Total energy=-2.79167676747  Egs=-0.908032882905
Kept: 849 out of 3195, ratio=0.266
Memory used: 20 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 11/66 (scale 0.022542110013890053) ***** 
[1] xi(10)=0.999512016628 zeta(11)=0
Stats: nr=33 min=2 max=397 sum3=190001532
Emax=8.00098610478 nrkept=805 nrkeptmult=1927 
Total energy=-2.82454435141  Egs=-1.45805268085
Kept: 805 out of 3186, ratio=0.253
Memory used: 21 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** 
[1] xi(11)=0.999755933863 zeta(12)=0
Stats: nr=38 min=1 max=331 sum3=158601980
Emax=8.07090465614 nrkept=849 nrkeptmult=2018 
Total energy=-2.83932680507  Egs=-0.927399717099
Kept: 849 out of 3020, ratio=0.281
Memory used: 21 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 13/66 (scale 0.011271055006945026) ***** 
[1] xi(12)=0.999877948312 zeta(13)=0
Stats: nr=33 min=2 max=397 sum3=190001532
Emax=8.00050161562 nrkept=788 nrkeptmult=1882 
Total energy=-2.8554975716  Egs=-1.43471631726
Kept: 788 out of 3186, ratio=0.247
Memory used: 22 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** 
[1] xi(13)=0.9999389695 zeta(14)=0
Stats: nr=38 min=1 max=323 sum3=147699698
Emax=8.15046013116 nrkept=849 nrkeptmult=2018 
Total energy=-2.86301746639  Egs=-0.9435440782
Kept: 849 out of 2954, ratio=0.287
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** 
[1] xi(14)=0.999969483586 zeta(15)=0
Stats: nr=33 min=2 max=397 sum3=190001532
Emax=8.00132787925 nrkept=730 nrkeptmult=1759 
Total energy=-2.87098518534  Egs=-1.41383729245
Kept: 730 out of 3186, ratio=0.229
Memory used: 23 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 16/66 (scale 0.0039849197132687088) ***** 
[1] xi(15)=0.999984741502 zeta(16)=0
Stats: nr=36 min=1 max=305 sum3=123074523
Emax=8.00287441851 nrkept=695 nrkeptmult=1660 
Total energy=-2.87480106346  Egs=-0.957579674949
Kept: 695 out of 2745, ratio=0.253
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 17/66 (scale 0.0028177637517362566) ***** 
[1] xi(16)=0.999992370678 zeta(17)=0
Stats: nr=33 min=1 max=333 sum3=109189985
Emax=8.00098643746 nrkept=624 nrkeptmult=1493 
Total energy=-2.87873003984  Egs=-1.39435975555
Kept: 624 out of 2609, ratio=0.239
Memory used: 22 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 18/66 (scale 0.0019924598566343544) ***** 
[1] xi(17)=0.999996185321 zeta(18)=0
Stats: nr=36 min=1 max=266 sum3=78555480
Emax=8.00970728037 nrkept=600 nrkeptmult=1444 
Total energy=-2.88066662377  Egs=-0.971956308391
Kept: 600 out of 2340, ratio=0.256
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 19/66 (scale 0.0014088818758681283) ***** 
[1] xi(18)=0.999998092656 zeta(19)=0
Stats: nr=32 min=1 max=291 sum3=72176008
Emax=8.00881499635 nrkept=526 nrkeptmult=1284 
Total energy=-2.88260224656  Egs=-1.37387159754
Kept: 526 out of 2254, ratio=0.233
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 20/66 (scale 0.0009962299283171772) ***** 
[1] xi(19)=0.999999046327 zeta(20)=0
Stats: nr=35 min=1 max=227 sum3=48717204
Emax=8.00318612457 nrkept=483 nrkeptmult=1185 
Total energy=-2.88358752426  Egs=-0.989006329033
Kept: 483 out of 1980, ratio=0.244
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 21/66 (scale 0.00070444093793406415) ***** 
[1] xi(20)=0.999999523163 zeta(21)=0
Stats: nr=31 min=2 max=234 sum3=37773683
Emax=8.00192221935 nrkept=449 nrkeptmult=1119 
Total energy=-2.8845386625  Egs=-1.35020295064
Kept: 449 out of 1817, ratio=0.247
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 22/66 (scale 0.0004981149641585886) ***** 
[1] xi(21)=0.999999761581 zeta(22)=0
Stats: nr=34 min=1 max=194 sum3=30653716
Emax=8.00937672108 nrkept=434 nrkeptmult=1085 
Total energy=-2.88504188023  Egs=-1.01024415313
Kept: 434 out of 1696, ratio=0.256
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 23/66 (scale 0.00035222046896703208) ***** 
[1] xi(22)=0.999999880791 zeta(23)=0
Stats: nr=31 min=2 max=205 sum3=26503498
Emax=8.00209924648 nrkept=417 nrkeptmult=1040 
Total energy=-2.88550745389  Egs=-1.32182456378
Kept: 417 out of 1636, ratio=0.255
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 24/66 (scale 0.0002490574820792943) ***** 
[1] xi(23)=0.999999940395 zeta(24)=0
Stats: nr=34 min=1 max=179 sum3=24311838
Emax=8.00900666069 nrkept=412 nrkeptmult=1043 
Total energy=-2.88576568265  Egs=-1.03682393944
Kept: 412 out of 1572, ratio=0.262
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 25/66 (scale 0.00017611023448351604) ***** 
[1] xi(24)=0.999999970198 zeta(25)=0
Stats: nr=31 min=2 max=195 sum3=22888394
Emax=8.00544155716 nrkept=412 nrkeptmult=1026 
Total energy=-2.88599241689  Egs=-1.28745634536
Kept: 412 out of 1556, ratio=0.265
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 26/66 (scale 0.00012452874103964715) ***** 
[1] xi(25)=0.999999985099 zeta(26)=0
Stats: nr=34 min=1 max=175 sum3=23209204
Emax=8.00248867634 nrkept=410 nrkeptmult=1039 
Total energy=-2.88612567144  Egs=-1.07007059983
Kept: 410 out of 1552, ratio=0.264
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 27/66 (scale 8.8055117241758019e-05) ***** 
[1] xi(26)=0.999999992549 zeta(27)=0
Stats: nr=31 min=2 max=193 sum3=22404109
Emax=8.0017173482 nrkept=406 nrkeptmult=1008 
Total energy=-2.88623536784  Egs=-1.2457697067
Kept: 406 out of 1549, ratio=0.262
Memory used: 23 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 28/66 (scale 6.2264370519823575e-05) ***** 
[1] xi(27)=0.999999996275 zeta(28)=0
Stats: nr=34 min=1 max=171 sum3=21897472
Emax=8.00478128097 nrkept=408 nrkeptmult=1036 
Total energy=-2.88630458522  Egs=-1.11166921502
Kept: 408 out of 1528, ratio=0.267
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 29/66 (scale 4.402755862087901e-05) ***** 
[1] xi(28)=0.999999998137 zeta(29)=0
Stats: nr=31 min=2 max=192 sum3=22075956
Emax=8.00915342003 nrkept=407 nrkeptmult=1009 
Total energy=-2.88635721858  Egs=-1.19546403399
Kept: 407 out of 1542, ratio=0.264
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 30/66 (scale 3.1132185259911788e-05) ***** 
[1] xi(29)=0.999999999069 zeta(30)=0
Stats: nr=34 min=1 max=171 sum3=22124666
Emax=8.01847205878 nrkept=405 nrkeptmult=1028 
Total energy=-2.88639344121  Egs=-1.16351051943
Kept: 405 out of 1532, ratio=0.264
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 31/66 (scale 2.2013779310439505e-05) ***** 
[1] xi(30)=0.999999999534 zeta(31)=0
Stats: nr=31 min=2 max=190 sum3=21479695
Emax=8.02236438549 nrkept=407 nrkeptmult=1008 
Total energy=-2.88641844531  Egs=-1.13583893301
Kept: 407 out of 1531, ratio=0.266
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 32/66 (scale 1.5566092629955894e-05) ***** 
[1] xi(31)=0.999999999767 zeta(32)=0
Stats: nr=34 min=1 max=171 sum3=22095938
Emax=8.01236264276 nrkept=396 nrkeptmult=997 
Total energy=-2.88643754483  Egs=-1.22699507725
Kept: 396 out of 1532, ratio=0.258
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 33/66 (scale 1.1006889655219752e-05) ***** 
[1] xi(32)=0.999999999884 zeta(33)=0
Stats: nr=31 min=1 max=187 sum3=20526363
Emax=8.00000319016 nrkept=401 nrkeptmult=981 
Total energy=-2.88644930114  Egs=-1.06808575774
Kept: 401 out of 1497, ratio=0.268
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 34/66 (scale 7.7830463149779469e-06) ***** 
[1] xi(33)=0.999999999942 zeta(34)=0
Stats: nr=32 min=1 max=170 sum3=21603093
Emax=8.00462862603 nrkept=380 nrkeptmult=936 
Total energy=-2.88645942979  Egs=-1.30137365339
Kept: 380 out of 1509, ratio=0.252
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 35/66 (scale 5.5034448276098762e-06) ***** 
[1] xi(34)=0.999999999971 zeta(35)=0
Stats: nr=31 min=1 max=185 sum3=19260570
Safeguard: keep additional 1 states
Emax=8.00071347886 nrkept=397 nrkeptmult=968 
Total energy=-2.88646491715  Egs=-0.997077823877
Kept: 397 out of 1434, ratio=0.277
Memory used: 24 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 36/66 (scale 3.8915231574889735e-06) ***** 
[1] xi(35)=0.999999999985 zeta(36)=0
Stats: nr=31 min=1 max=169 sum3=21247428
Emax=8.00141894965 nrkept=364 nrkeptmult=877 
Total energy=-2.88647029236  Egs=-1.38126195366
Kept: 364 out of 1494, ratio=0.244
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 37/66 (scale 2.7517224138049381e-06) ***** 
[1] xi(36)=0.999999999993 zeta(37)=0
Stats: nr=31 min=1 max=183 sum3=17740515
Emax=8.01393671203 nrkept=378 nrkeptmult=905 
Total energy=-2.88647285591  Egs=-0.931616656948
Kept: 378 out of 1371, ratio=0.276
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 38/66 (scale 1.9457615787444867e-06) ***** 
[1] xi(37)=0.999999999996 zeta(38)=0
Stats: nr=30 min=1 max=166 sum3=19301633
Emax=8.01872128779 nrkept=334 nrkeptmult=782 
Total energy=-2.88647568892  Egs=-1.45598645185
Kept: 334 out of 1421, ratio=0.235
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 39/66 (scale 1.3758612069024691e-06) ***** 
[1] xi(38)=0.999999999998 zeta(39)=0
Stats: nr=31 min=1 max=173 sum3=14245060
Emax=8.02140573989 nrkept=350 nrkeptmult=817 
Total energy=-2.88647690005  Egs=-0.880270682972
Kept: 350 out of 1252, ratio=0.28
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 40/66 (scale 9.7288078937224336e-07) ***** 
[1] xi(39)=0.999999999999 zeta(40)=0
Stats: nr=26 min=1 max=157 sum3=16071629
Emax=8.00319742051 nrkept=304 nrkeptmult=709 
Total energy=-2.88647837374  Egs=-1.51477780528
Kept: 304 out of 1313, ratio=0.232
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 41/66 (scale 6.8793060345123453e-07) ***** 
[1] xi(40)=1 zeta(41)=0
Stats: nr=31 min=1 max=159 sum3=10787176
Emax=8.00542551314 nrkept=339 nrkeptmult=786 
Total energy=-2.88647895563  Egs=-0.845845691331
Kept: 339 out of 1138, ratio=0.298
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 42/66 (scale 4.8644039468612168e-07) ***** 
[1] xi(41)=1 zeta(42)=0
Stats: nr=26 min=1 max=153 sum3=14716978
Emax=8.00567325777 nrkept=277 nrkeptmult=635 
Total energy=-2.88647971154  Egs=-1.55397624448
Kept: 277 out of 1270, ratio=0.218
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 43/66 (scale 3.4396530172561726e-07) ***** 
[1] xi(42)=1 zeta(43)=0
Stats: nr=29 min=1 max=144 sum3=8107167
Emax=8.00353951327 nrkept=311 nrkeptmult=721 
Total energy=-2.88647999545  Egs=-0.825378763537
Kept: 311 out of 1035, ratio=0.3
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 44/66 (scale 2.4322019734306084e-07) ***** 
[1] xi(43)=1 zeta(44)=0
Stats: nr=26 min=1 max=141 sum3=11344968
Emax=8.00781238951 nrkept=260 nrkeptmult=582 
Total energy=-2.88648037902  Egs=-1.57707710677
Kept: 260 out of 1164, ratio=0.223
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 45/66 (scale 1.7198265086280863e-07) ***** 
[1] xi(44)=1 zeta(45)=0
Stats: nr=29 min=1 max=138 sum3=6977812
Emax=8.00168459484 nrkept=264 nrkeptmult=605 
Total energy=-2.88648051981  Egs=-0.818613225376
Kept: 264 out of 970, ratio=0.272
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 46/66 (scale 1.2161009867153042e-07) ***** 
[1] xi(45)=1 zeta(46)=0
Stats: nr=26 min=1 max=122 sum3=7137579
Emax=8.18390817426 nrkept=258 nrkeptmult=578 
Total energy=-2.88648071236  Egs=-1.58333057285
Kept: 258 out of 987, ratio=0.261
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 47/66 (scale 8.5991325431404316e-08) ***** 
[1] xi(46)=1 zeta(47)=0
Stats: nr=29 min=1 max=137 sum3=6825567
Emax=8.00228853466 nrkept=237 nrkeptmult=525 
Total energy=-2.88648078268  Egs=-0.817733032559
Kept: 237 out of 963, ratio=0.246
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 48/66 (scale 6.080504933576521e-08) ***** 
[1] xi(47)=1 zeta(48)=0
Stats: nr=25 min=2 max=111 sum3=5422032
Emax=8.00855180729 nrkept=257 nrkeptmult=575 
Total energy=-2.88648087892  Egs=-1.58279632424
Kept: 257 out of 882, ratio=0.291
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 49/66 (scale 4.2995662715702158e-08) ***** 
[1] xi(48)=1 zeta(49)=0
Stats: nr=29 min=1 max=136 sum3=6707639
Emax=8.00301247225 nrkept=234 nrkeptmult=517 
Total energy=-2.88648091406  Egs=-0.817274250669
Kept: 234 out of 959, ratio=0.244
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 50/66 (scale 3.0402524667882605e-08) ***** 
[1] xi(49)=1 zeta(50)=0
Stats: nr=25 min=2 max=111 sum3=5288293
Emax=8.00132352894 nrkept=256 nrkeptmult=574 
Total energy=-2.88648096217  Egs=-1.5825211866
Kept: 256 out of 871, ratio=0.294
Memory used: 24 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 51/66 (scale 2.1497831357851079e-08) ***** 
[1] xi(50)=1 zeta(51)=0
Stats: nr=29 min=1 max=136 sum3=6664784
Emax=8.01431867266 nrkept=233 nrkeptmult=514 
Total energy=-2.88648097974  Egs=-0.817039849611
Kept: 233 out of 956, ratio=0.244
Memory used: 24 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 52/66 (scale 1.5201262333941303e-08) ***** 
[1] xi(51)=1 zeta(52)=0
Stats: nr=25 min=2 max=111 sum3=5209269
Emax=8.00020901063 nrkept=254 nrkeptmult=570 
Total energy=-2.88648100379  Egs=-1.58238151066
Kept: 254 out of 867, ratio=0.293
Memory used: 24 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 53/66 (scale 1.0748915678925539e-08) ***** 
[1] xi(52)=1 zeta(53)=0
Stats: nr=29 min=1 max=135 sum3=6522192
Emax=8.00945112792 nrkept=232 nrkeptmult=512 
Total energy=-2.88648101257  Egs=-0.816921350869
Kept: 232 out of 948, ratio=0.245
Memory used: 24 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 54/66 (scale 7.6006311669706513e-09) ***** 
[1] xi(53)=1 zeta(54)=0
Stats: nr=25 min=2 max=110 sum3=5084291
Emax=8.00087580619 nrkept=252 nrkeptmult=567 
Total energy=-2.8864810246  Egs=-1.5823110926
Kept: 252 out of 863, ratio=0.292
Memory used: 24 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 55/66 (scale 5.3744578394627697e-09) ***** 
[1] xi(54)=1 zeta(55)=0
Stats: nr=29 min=1 max=134 sum3=6403517
Emax=8.00218243283 nrkept=231 nrkeptmult=510 
Total energy=-2.88648102899  Egs=-0.816861796334
Kept: 231 out of 941, ratio=0.245
Memory used: 24 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 56/66 (scale 3.8003155834853256e-09) ***** 
[1] xi(55)=1 zeta(56)=0
Stats: nr=25 min=2 max=109 sum3=4961743
Emax=8.00042533549 nrkept=250 nrkeptmult=562 
Total energy=-2.886481035  Egs=-1.58227573324
Kept: 250 out of 859, ratio=0.291
Memory used: 24 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 57/66 (scale 2.6872289197313849e-09) ***** 
[1] xi(56)=1 zeta(57)=0
Stats: nr=29 min=1 max=133 sum3=6269289
Emax=8.00193774635 nrkept=230 nrkeptmult=509 
Total energy=-2.8864810372  Egs=-0.816831947346
Kept: 230 out of 933, ratio=0.247
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 58/66 (scale 1.9001577917426628e-09) ***** 
[1] xi(57)=1 zeta(58)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Emax=8.00265887046 nrkept=250 nrkeptmult=562 
Total energy=-2.8864810402  Egs=-1.58225799936
Kept: 250 out of 856, ratio=0.292
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 59/66 (scale 1.3436144598656924e-09) ***** 
[1] xi(58)=1 zeta(59)=0
Stats: nr=29 min=1 max=133 sum3=6269289
Emax=8.00330259451 nrkept=230 nrkeptmult=509 
Total energy=-2.8864810413  Egs=-0.81681701488
Kept: 230 out of 933, ratio=0.247
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 60/66 (scale 9.5007889587133141e-10) ***** 
[1] xi(59)=1 zeta(60)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Emax=8.00377667931 nrkept=250 nrkeptmult=562 
Total energy=-2.8864810428  Egs=-1.58224910824
Kept: 250 out of 856, ratio=0.292
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 61/66 (scale 6.7180722993284622e-10) ***** 
[1] xi(60)=1 zeta(61)=0
Stats: nr=29 min=1 max=133 sum3=6269289
Emax=8.00398371962 nrkept=230 nrkeptmult=509 
Total energy=-2.88648104335  Egs=-0.81680955467
Kept: 230 out of 933, ratio=0.247
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 62/66 (scale 4.750394479356657e-10) ***** 
[1] xi(61)=1 zeta(62)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Emax=8.00433588599 nrkept=250 nrkeptmult=562 
Total energy=-2.8864810441  Egs=-1.58224464488
Kept: 250 out of 856, ratio=0.292
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 63/66 (scale 3.3590361496642311e-10) ***** 
[1] xi(62)=1 zeta(63)=0
Stats: nr=29 min=1 max=133 sum3=6269289
Emax=8.00432398405 nrkept=230 nrkeptmult=509 
Total energy=-2.88648104438  Egs=-0.816805834553
Kept: 230 out of 933, ratio=0.247
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 64/66 (scale 2.3751972396783285e-10) ***** 
[1] xi(63)=1 zeta(64)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Emax=8.00461560119 nrkept=250 nrkeptmult=562 
Total energy=-2.88648104475  Egs=-1.58224239696
Kept: 250 out of 856, ratio=0.292
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 65/66 (scale 1.6795180748321155e-10) ***** 
[1] xi(64)=1 zeta(65)=0
Stats: nr=29 min=1 max=133 sum3=6269289
Emax=8.00449403761 nrkept=230 nrkeptmult=509 
Total energy=-2.88648104489  Egs=-0.816803985487
Kept: 230 out of 933, ratio=0.247
Memory used: 25 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 66/66 (scale 1.1875986198391643e-10) ***** 
[1] xi(65)=1 zeta(66)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Emax=8.00475552206 nrkept=250 nrkeptmult=562 
Total energy=-2.88648104508  Egs=-1.58224125712
Kept: 250 out of 856, ratio=0.292
Memory used: 25 MB  Time elapsed: 11 s

** Iteration completed.


Total energy:              -2.88648104507861
TKW=1.49053103465e-06
Grand canonical Z=              9.638045854114139
Zft (last shell)=               9.563070657636835

Memory usage report
===================
  after diag: 29096 kB
after recalc: 26016 kB
 after split: 30108 kB
  after trim: 26016 kB
 after trunc: 29176 kB
      diag_h: 29096 kB

Peak usage: 30108 kB

Timing report
=============
         All: 11 s
        diag: 9 s
       Other: 2 s
