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=	0.02	 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
0.025468586729 
(-1 2) 2 states
0.0123000444946 0.0533410011155 
(0 1) 3 states
0 0.0440589853179 0.0862609727599 
(0 3) 1 states
0.040172458881 
(1 2) 2 states
0.0296840799071 0.0751672914417 
(2 1) 1 states
0.0646789124678 
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=3.08104063854 nrkept=35 nrkeptmult=64 
Total energy=-1.08625647911  Egs=-1.47678468276
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=5.49959752754 nrkept=126 nrkeptmult=256 
Total energy=-1.37905659083  Egs=-0.574039387841
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 1 states
Emax=8.00249407522 nrkept=395 nrkeptmult=887 
Total energy=-1.91915882556  Egs=-1.49748136487
Kept: 395 out of 462, ratio=0.855
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=175 sum3=21745182
Emax=8.0669074749 nrkept=715 nrkeptmult=1698 
Total energy=-2.11224677125  Egs=-0.757104124662
Kept: 715 out of 1470, ratio=0.486
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=333 sum3=112070562
Emax=8.00434446708 nrkept=815 nrkeptmult=1947 
Total energy=-2.39119438021  Egs=-1.54681398939
Kept: 815 out of 2682, ratio=0.304
Memory used: 12 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=341 sum3=165055395
Emax=8.03201268451 nrkept=849 nrkeptmult=2018 
Total energy=-2.49454544553  Egs=-0.81048578735
Kept: 849 out of 3063, ratio=0.277
Memory used: 13 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=8.01302027031 nrkept=815 nrkeptmult=1946 
Total energy=-2.63536216956  Egs=-1.56170744376
Kept: 815 out of 3186, ratio=0.256
Memory used: 17 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=340 sum3=164008616
Emax=8.02977150924 nrkept=849 nrkeptmult=2018 
Total energy=-2.68788996885  Egs=-0.823852848323
Kept: 849 out of 3062, ratio=0.277
Memory used: 17 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=8.01613342752 nrkept=765 nrkeptmult=1826 
Total energy=-2.75853543782  Egs=-1.56696664416
Kept: 765 out of 3186, ratio=0.24
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=37 min=1 max=327 sum3=139815586
Emax=8.00070732764 nrkept=753 nrkeptmult=1795 
Total energy=-2.7848561507  Egs=-0.825634980619
Kept: 753 out of 2878, ratio=0.262
Memory used: 19 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 11/66 (scale 0.022542110013890053) ***** 
[1] xi(10)=0.999512016628 zeta(11)=0
Stats: nr=33 min=1 max=356 sum3=135727656
Emax=8.01901664038 nrkept=695 nrkeptmult=1657 
Total energy=-2.82026355341  Egs=-1.5707226469
Kept: 695 out of 2826, ratio=0.246
Memory used: 20 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** 
[1] xi(11)=0.999755933863 zeta(12)=0
Stats: nr=37 min=1 max=300 sum3=105996780
Emax=8.00508402489 nrkept=707 nrkeptmult=1693 
Total energy=-2.83339908336  Egs=-0.824077452978
Kept: 707 out of 2610, ratio=0.271
Memory used: 20 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 13/66 (scale 0.011271055006945026) ***** 
[1] xi(12)=0.999877948312 zeta(13)=0
Stats: nr=33 min=1 max=332 sum3=111894003
Emax=8.0004646495 nrkept=540 nrkeptmult=1267 
Total energy=-2.85114012163  Egs=-1.57403528412
Kept: 540 out of 2655, ratio=0.203
Memory used: 20 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** 
[1] xi(13)=0.9999389695 zeta(14)=0
Stats: nr=33 min=1 max=248 sum3=53158759
Emax=8.00222649849 nrkept=482 nrkeptmult=1121 
Total energy=-2.85769173454  Egs=-0.822050805092
Kept: 482 out of 2023, ratio=0.238
Memory used: 21 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** 
[1] xi(14)=0.999969483586 zeta(15)=0
Stats: nr=32 min=1 max=234 sum3=39229455
Emax=8.00579121744 nrkept=388 nrkeptmult=898 
Total energy=-2.86657590405  Egs=-1.5764574843
Kept: 388 out of 1803, ratio=0.215
Memory used: 21 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 16/66 (scale 0.0039849197132687088) ***** 
[1] xi(15)=0.999984741502 zeta(16)=0
Stats: nr=31 min=1 max=190 sum3=21081093
Emax=8.00009316729 nrkept=343 nrkeptmult=786 
Total energy=-2.8698457912  Egs=-0.820565375801
Kept: 343 out of 1455, ratio=0.236
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 17/66 (scale 0.0028177637517362566) ***** 
[1] xi(16)=0.999992370678 zeta(17)=0
Stats: nr=28 min=1 max=170 sum3=15474172
Emax=8.00442329329 nrkept=274 nrkeptmult=614 
Total energy=-2.87429198105  Egs=-1.57791434707
Kept: 274 out of 1282, ratio=0.214
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 18/66 (scale 0.0019924598566343544) ***** 
[1] xi(17)=0.999996185321 zeta(18)=0
Stats: nr=29 min=1 max=144 sum3=8034884
Emax=8.01940441174 nrkept=237 nrkeptmult=522 
Total energy=-2.8759251976  Egs=-0.819698598953
Kept: 237 out of 1022, ratio=0.232
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 19/66 (scale 0.0014088818758681283) ***** 
[1] xi(18)=0.999998092656 zeta(19)=0
Stats: nr=25 min=2 max=115 sum3=5555046
Emax=8.01400691765 nrkept=255 nrkeptmult=572 
Total energy=-2.87814939545  Egs=-1.57869718575
Kept: 255 out of 882, ratio=0.289
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 20/66 (scale 0.0009962299283171772) ***** 
[1] xi(19)=0.999999046327 zeta(20)=0
Stats: nr=29 min=1 max=135 sum3=6544594
Emax=8.00967768365 nrkept=232 nrkeptmult=512 
Total energy=-2.87896554694  Egs=-0.819240084657
Kept: 232 out of 952, ratio=0.244
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 21/66 (scale 0.00070444093793406415) ***** 
[1] xi(20)=0.999999523163 zeta(21)=0
Stats: nr=25 min=2 max=110 sum3=5084291
Emax=8.00443561506 nrkept=252 nrkeptmult=566 
Total energy=-2.88007792855  Egs=-1.57909846889
Kept: 252 out of 863, ratio=0.292
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 22/66 (scale 0.0004981149641585886) ***** 
[1] xi(21)=0.999999761581 zeta(22)=0
Stats: nr=29 min=1 max=135 sum3=6479902
Emax=8.01555836205 nrkept=232 nrkeptmult=512 
Total energy=-2.88048588777  Egs=-0.819006161044
Kept: 232 out of 940, ratio=0.247
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 23/66 (scale 0.00035222046896703208) ***** 
[1] xi(22)=0.999999880791 zeta(23)=0
Stats: nr=25 min=2 max=110 sum3=5084291
Emax=8.00482849387 nrkept=250 nrkeptmult=561 
Total energy=-2.88104214985  Egs=-1.57930082893
Kept: 250 out of 863, ratio=0.29
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 24/66 (scale 0.0002490574820792943) ***** 
[1] xi(23)=0.999999940395 zeta(24)=0
Stats: nr=29 min=1 max=134 sum3=6378651
Emax=8.00114206177 nrkept=230 nrkeptmult=509 
Total energy=-2.88124610011  Egs=-0.818888307086
Kept: 230 out of 933, ratio=0.247
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 25/66 (scale 0.00017611023448351604) ***** 
[1] xi(24)=0.999999970198 zeta(25)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Emax=8.00811839287 nrkept=250 nrkeptmult=561 
Total energy=-2.88152424903  Egs=-1.57940232179
Kept: 250 out of 856, ratio=0.292
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 26/66 (scale 0.00012452874103964715) ***** 
[1] xi(25)=0.999999985099 zeta(26)=0
Stats: nr=29 min=1 max=134 sum3=6378651
Emax=8.00245202002 nrkept=230 nrkeptmult=509 
Total energy=-2.8816262168  Egs=-0.818829203018
Kept: 230 out of 933, ratio=0.247
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 27/66 (scale 8.8055117241758019e-05) ***** 
[1] xi(26)=0.999999992549 zeta(27)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.00975738712 nrkept=251 nrkeptmult=562 
Total energy=-2.88176529573  Egs=-1.57945312039
Kept: 251 out of 856, ratio=0.293
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 28/66 (scale 6.2264370519823575e-05) ***** 
[1] xi(27)=0.999999996275 zeta(28)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00309589186 nrkept=230 nrkeptmult=509 
Total energy=-2.88181627777  Egs=-0.818799621465
Kept: 230 out of 936, ratio=0.246
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 29/66 (scale 4.402755862087901e-05) ***** 
[1] xi(28)=0.999999998137 zeta(29)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01056798763 nrkept=251 nrkeptmult=562 
Total energy=-2.88188581835  Egs=-1.57947851819
Kept: 251 out of 856, ratio=0.293
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 30/66 (scale 3.1132185259911788e-05) ***** 
[1] xi(29)=0.999999999069 zeta(30)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.0034153249 nrkept=230 nrkeptmult=509 
Total energy=-2.88191130891  Egs=-0.818784831099
Kept: 230 out of 936, ratio=0.246
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 31/66 (scale 2.2013779310439505e-05) ***** 
[1] xi(30)=0.999999999534 zeta(31)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01097327267 nrkept=251 nrkeptmult=562 
Total energy=-2.88194607948  Egs=-1.57949120537
Kept: 251 out of 856, ratio=0.293
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 32/66 (scale 1.5566092629955894e-05) ***** 
[1] xi(31)=0.999999999767 zeta(32)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00357442807 nrkept=230 nrkeptmult=509 
Total energy=-2.88195882465  Egs=-0.818777444548
Kept: 230 out of 936, ratio=0.246
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 33/66 (scale 1.1006889655219752e-05) ***** 
[1] xi(32)=0.999999999884 zeta(33)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01117595056 nrkept=251 nrkeptmult=562 
Total energy=-2.88197621  Egs=-1.57949753444
Kept: 251 out of 856, ratio=0.293
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 34/66 (scale 7.7830463149779469e-06) ***** 
[1] xi(33)=0.999999999942 zeta(34)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00365382407 nrkept=230 nrkeptmult=509 
Total energy=-2.88198258256  Egs=-0.818773761738
Kept: 230 out of 936, ratio=0.246
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 35/66 (scale 5.5034448276098762e-06) ***** 
[1] xi(34)=0.999999999971 zeta(35)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01127730168 nrkept=251 nrkeptmult=562 
Total energy=-2.88199127525  Egs=-1.57950068383
Kept: 251 out of 856, ratio=0.293
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 36/66 (scale 3.8915231574889735e-06) ***** 
[1] xi(35)=0.999999999985 zeta(36)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.0036934794 nrkept=230 nrkeptmult=509 
Total energy=-2.88199446152  Egs=-0.818771931243
Kept: 230 out of 936, ratio=0.246
Memory used: 21 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 37/66 (scale 2.7517224138049381e-06) ***** 
[1] xi(36)=0.999999999993 zeta(37)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.011327981 nrkept=251 nrkeptmult=562 
Total energy=-2.88199880787  Egs=-1.57950224322
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 38/66 (scale 1.9457615787444867e-06) ***** 
[1] xi(37)=0.999999999996 zeta(38)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00371329246 nrkept=230 nrkeptmult=509 
Total energy=-2.88200040101  Egs=-0.818771027014
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 39/66 (scale 1.3758612069024691e-06) ***** 
[1] xi(38)=0.999999999998 zeta(39)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01135332194 nrkept=251 nrkeptmult=562 
Total energy=-2.88200257418  Egs=-1.57950300757
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 40/66 (scale 9.7288078937224336e-07) ***** 
[1] xi(39)=0.999999999999 zeta(40)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00372319142 nrkept=230 nrkeptmult=509 
Total energy=-2.88200337075  Egs=-0.818770585943
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 41/66 (scale 6.8793060345123453e-07) ***** 
[1] xi(40)=1 zeta(41)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01136599301 nrkept=251 nrkeptmult=562 
Total energy=-2.88200445734  Egs=-1.5795033744
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 42/66 (scale 4.8644039468612168e-07) ***** 
[1] xi(41)=1 zeta(42)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00372813508 nrkept=230 nrkeptmult=509 
Total energy=-2.88200485562  Egs=-0.818770376457
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 43/66 (scale 3.4396530172561726e-07) ***** 
[1] xi(42)=1 zeta(43)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137232899 nrkept=251 nrkeptmult=562 
Total energy=-2.88200539892  Egs=-1.57950354247
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 44/66 (scale 2.4322019734306084e-07) ***** 
[1] xi(43)=1 zeta(44)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373060155 nrkept=230 nrkeptmult=509 
Total energy=-2.88200559806  Egs=-0.818770282765
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 45/66 (scale 1.7198265086280863e-07) ***** 
[1] xi(44)=1 zeta(45)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137549738 nrkept=251 nrkeptmult=562 
Total energy=-2.88200586971  Egs=-1.57950361115
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 46/66 (scale 1.2161009867153042e-07) ***** 
[1] xi(45)=1 zeta(46)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373182952 nrkept=230 nrkeptmult=509 
Total energy=-2.88200596928  Egs=-0.81877024697
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 47/66 (scale 8.5991325431404316e-08) ***** 
[1] xi(46)=1 zeta(47)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137708197 nrkept=251 nrkeptmult=562 
Total energy=-2.8820061051  Egs=-1.57950363014
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 48/66 (scale 6.080504933576521e-08) ***** 
[1] xi(47)=1 zeta(48)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373243829 nrkept=230 nrkeptmult=509 
Total energy=-2.88200615489  Egs=-0.818770240124
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 49/66 (scale 4.2995662715702158e-08) ***** 
[1] xi(48)=1 zeta(49)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137787467 nrkept=251 nrkeptmult=562 
Total energy=-2.8820062228  Egs=-1.57950362429
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 50/66 (scale 3.0402524667882605e-08) ***** 
[1] xi(49)=1 zeta(50)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373273745 nrkept=230 nrkeptmult=509 
Total energy=-2.88200624769  Egs=-0.818770247752
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 51/66 (scale 2.1497831357851079e-08) ***** 
[1] xi(50)=1 zeta(51)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137827141 nrkept=251 nrkeptmult=562 
Total energy=-2.88200628165  Egs=-1.57950360601
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 52/66 (scale 1.5201262333941303e-08) ***** 
[1] xi(51)=1 zeta(52)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373288182 nrkept=230 nrkeptmult=509 
Total energy=-2.88200629409  Egs=-0.818770262617
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 53/66 (scale 1.0748915678925539e-08) ***** 
[1] xi(52)=1 zeta(53)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137847018 nrkept=251 nrkeptmult=562 
Total energy=-2.88200631107  Egs=-1.57950358152
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 54/66 (scale 7.6006311669706513e-09) ***** 
[1] xi(53)=1 zeta(54)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373294879 nrkept=230 nrkeptmult=509 
Total energy=-2.88200631729  Egs=-0.8187702811
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 55/66 (scale 5.3744578394627697e-09) ***** 
[1] xi(54)=1 zeta(55)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137856996 nrkept=251 nrkeptmult=562 
Total energy=-2.88200632578  Egs=-1.57950355393
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 56/66 (scale 3.8003155834853256e-09) ***** 
[1] xi(55)=1 zeta(56)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373297706 nrkept=230 nrkeptmult=509 
Total energy=-2.88200632889  Egs=-0.818770301393
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 57/66 (scale 2.6872289197313849e-09) ***** 
[1] xi(56)=1 zeta(57)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137862026 nrkept=251 nrkeptmult=562 
Total energy=-2.88200633314  Egs=-1.57950352478
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 58/66 (scale 1.9001577917426628e-09) ***** 
[1] xi(57)=1 zeta(58)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373298598 nrkept=230 nrkeptmult=509 
Total energy=-2.88200633469  Egs=-0.818770322591
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 59/66 (scale 1.3436144598656924e-09) ***** 
[1] xi(58)=1 zeta(59)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.0113786458 nrkept=251 nrkeptmult=562 
Total energy=-2.88200633682  Egs=-1.57950349486
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 60/66 (scale 9.5007889587133141e-10) ***** 
[1] xi(59)=1 zeta(60)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373298523 nrkept=230 nrkeptmult=509 
Total energy=-2.88200633759  Egs=-0.81877034424
Kept: 230 out of 936, ratio=0.246
Memory used: 22 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 61/66 (scale 6.7180722993284622e-10) ***** 
[1] xi(60)=1 zeta(61)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137865897 nrkept=251 nrkeptmult=562 
Total energy=-2.88200633866  Egs=-1.57950346455
Kept: 251 out of 856, ratio=0.293
Memory used: 22 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 62/66 (scale 4.750394479356657e-10) ***** 
[1] xi(61)=1 zeta(62)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373297964 nrkept=230 nrkeptmult=509 
Total energy=-2.88200633904  Egs=-0.818770366116
Kept: 230 out of 936, ratio=0.246
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 63/66 (scale 3.3590361496642311e-10) ***** 
[1] xi(62)=1 zeta(63)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137866596 nrkept=251 nrkeptmult=562 
Total energy=-2.88200633957  Egs=-1.57950343404
Kept: 251 out of 856, ratio=0.293
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 64/66 (scale 2.3751972396783285e-10) ***** 
[1] xi(63)=1 zeta(64)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373297163 nrkept=230 nrkeptmult=509 
Total energy=-2.88200633977  Egs=-0.818770388105
Kept: 230 out of 936, ratio=0.246
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 65/66 (scale 1.6795180748321155e-10) ***** 
[1] xi(64)=1 zeta(65)=0
Stats: nr=25 min=2 max=108 sum3=4894342
Safeguard: keep additional 1 states
Emax=8.01137866985 nrkept=251 nrkeptmult=562 
Total energy=-2.88200634003  Egs=-1.57950340344
Kept: 251 out of 856, ratio=0.293
Memory used: 23 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 66/66 (scale 1.1875986198391643e-10) ***** 
[1] xi(65)=1 zeta(66)=0
Stats: nr=29 min=1 max=135 sum3=6475770
Emax=8.00373296242 nrkept=230 nrkeptmult=509 
Total energy=-2.88200634013  Egs=-0.818770410151
Kept: 230 out of 936, ratio=0.246
Memory used: 23 MB  Time elapsed: 7 s

** Iteration completed.


Total energy:             -2.882006340131657
TKW=0.00956588253882
Grand canonical Z=              13.20897912368238
Zft (last shell)=               13.08732064620608

Memory usage report
===================
  after diag: 25432 kB
after recalc: 23844 kB
 after split: 27084 kB
  after trim: 23844 kB
 after trunc: 25472 kB
      diag_h: 25432 kB

Peak usage: 27084 kB

Timing report
=============
         All: 7 s
        diag: 5 s
    recalc f: 0 s
       Other: 1 s
