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 May 31 2013 at 20:34:53

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=100
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: 	kondo.m	 Variant: 		 Channels: 	1
>>  U=	0.1	 Gamma=	0.1	 Delta=	0.	 t=	0.
>> 	 extraJkondo=	0.2
>>  Gamma^(1/2)=	0.252313252202016
>>  Lambda=	2.	 BAND=	flat
>>  DISCRETIZATION=	Z	 z=	1.
>>  ops=	
V7
>>  Number of channels, impurities, subspaces: 
channels=1 impurities=0 subspaces=4
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=0 betabar=1

Number of invariant subspaces: 4
(-1 2) 1 states
0.14703872152 
(0 1) 1 states
0 
(0 3) 1 states
0.196051628694 
(1 2) 1 states
0.14703872152 
Number of states (multiplicity taken into account): 8

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=8 min=1 max=4 sum3=99
Emax=3.03331418188 nrkept=15 nrkeptmult=32 
Total energy=-1.09435275982  Egs=-1.30915090584
Kept: 15 out of 15, 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=13 min=1 max=9 sum3=2864
Emax=5.54079942945 nrkept=56 nrkeptmult=128 
Total energy=-1.43492840202  Egs=-0.667704093479
Kept: 56 out of 56, 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=19 min=1 max=35 sum3=99630
Safeguard: keep additional 2 states
Emax=8.01804897751 nrkept=187 nrkeptmult=456 
Total energy=-1.92821069776  Egs=-1.36766893005
Kept: 187 out of 210, ratio=0.89
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=26 min=1 max=86 sum3=2572630
Safeguard: keep additional 1 states
Emax=8.02704364029 nrkept=332 nrkeptmult=852 
Total energy=-2.14516713899  Egs=-0.850693273171
Kept: 332 out of 706, ratio=0.47
Memory used: 4 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/66 (scale 0.18033688011112042) ***** 
[1] xi(4)=0.96993426226 zeta(5)=0
Stats: nr=31 min=2 max=156 sum3=11912746
Safeguard: keep additional 2 states
Emax=8.00305797061 nrkept=402 nrkeptmult=1006 
Total energy=-2.4006645466  Egs=-1.41677846182
Kept: 402 out of 1258, ratio=0.32
Memory used: 7 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/66 (scale 0.12751743082459868) ***** 
[1] xi(5)=0.984675515632 zeta(6)=0
Stats: nr=34 min=1 max=169 sum3=20988614
Emax=8.00736065413 nrkept=398 nrkeptmult=1016 
Total energy=-2.51680144511  Egs=-0.910753124127
Kept: 398 out of 1514, ratio=0.263
Memory used: 9 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/66 (scale 0.090168440055560212) ***** 
[1] xi(6)=0.992263204714 zeta(7)=0
Stats: nr=31 min=2 max=188 sum3=20651778
Safeguard: keep additional 3 states
Emax=8.00177928184 nrkept=411 nrkeptmult=1030 
Total energy=-2.64502757784  Egs=-1.42207331797
Kept: 411 out of 1506, ratio=0.273
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/66 (scale 0.063758715412299341) ***** 
[1] xi(7)=0.996112749408 zeta(8)=0
Stats: nr=34 min=1 max=174 sum3=22432764
Safeguard: keep additional 1 states
Emax=8.04818591516 nrkept=400 nrkeptmult=1024 
Total energy=-2.70463236205  Egs=-0.934849201794
Kept: 400 out of 1548, ratio=0.258
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/66 (scale 0.045084220027780106) ***** 
[1] xi(8)=0.998051634085 zeta(9)=0
Stats: nr=31 min=2 max=188 sum3=20896340
Safeguard: keep additional 1 states
Emax=8.00104134152 nrkept=413 nrkeptmult=1036 
Total energy=-2.76829924842  Egs=-1.41217672913
Kept: 413 out of 1514, ratio=0.273
Memory used: 12 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/66 (scale 0.031879357706149671) ***** 
[1] xi(9)=0.99902462843 zeta(10)=0
Stats: nr=34 min=1 max=176 sum3=22901810
Safeguard: keep additional 1 states
Emax=8.03454962249 nrkept=400 nrkeptmult=1024 
Total energy=-2.7986139703  Egs=-0.95092009555
Kept: 400 out of 1556, ratio=0.257
Memory used: 13 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 11/66 (scale 0.022542110013890053) ***** 
[1] xi(10)=0.999512016628 zeta(11)=0
Stats: nr=31 min=2 max=188 sum3=20896340
Safeguard: keep additional 3 states
Emax=8.00180478743 nrkept=411 nrkeptmult=1030 
Total energy=-2.83009163571  Egs=-1.39639392202
Kept: 411 out of 1514, ratio=0.271
Memory used: 13 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** 
[1] xi(11)=0.999755933863 zeta(12)=0
Stats: nr=34 min=1 max=174 sum3=22432764
Safeguard: keep additional 1 states
Emax=8.02413210011 nrkept=400 nrkeptmult=1024 
Total energy=-2.84550215823  Egs=-0.96680257228
Kept: 400 out of 1548, ratio=0.258
Memory used: 13 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 13/66 (scale 0.011271055006945026) ***** 
[1] xi(12)=0.999877948312 zeta(13)=0
Stats: nr=31 min=2 max=188 sum3=20896340
Safeguard: keep additional 1 states
Emax=8.00048623209 nrkept=406 nrkeptmult=1014 
Total energy=-2.86101984574  Egs=-1.37677329246
Kept: 406 out of 1514, ratio=0.268
Memory used: 14 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** 
[1] xi(13)=0.9999389695 zeta(14)=0
Stats: nr=34 min=1 max=171 sum3=21746500
Safeguard: keep additional 1 states
Emax=8.01581295708 nrkept=400 nrkeptmult=1024 
Total energy=-2.86887004765  Egs=-0.984988717766
Kept: 400 out of 1528, ratio=0.262
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** 
[1] xi(14)=0.999969483586 zeta(15)=0
Stats: nr=31 min=2 max=188 sum3=20896340
Safeguard: keep additional 1 states
Emax=8.00624915778 nrkept=403 nrkeptmult=1002 
Total energy=-2.87649636442  Egs=-1.35325695156
Kept: 403 out of 1514, ratio=0.266
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 16/66 (scale 0.0039849197132687088) ***** 
[1] xi(15)=0.999984741502 zeta(16)=0
Stats: nr=34 min=1 max=170 sum3=21487354
Safeguard: keep additional 1 states
Emax=8.01035698747 nrkept=400 nrkeptmult=1024 
Total energy=-2.88050826139  Egs=-1.00676983722
Kept: 400 out of 1516, ratio=0.264
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 17/66 (scale 0.0028177637517362566) ***** 
[1] xi(16)=0.999992370678 zeta(17)=0
Stats: nr=31 min=2 max=188 sum3=20896340
Safeguard: keep additional 2 states
Emax=8.01230857102 nrkept=404 nrkeptmult=1002 
Total energy=-2.88424205378  Egs=-1.32509064272
Kept: 404 out of 1514, ratio=0.267
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 18/66 (scale 0.0019924598566343544) ***** 
[1] xi(17)=0.999996185321 zeta(18)=0
Stats: nr=34 min=1 max=169 sum3=21629876
Emax=8.00223422345 nrkept=398 nrkeptmult=1016 
Total energy=-2.88630096341  Egs=-1.03335062253
Kept: 398 out of 1520, ratio=0.262
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 19/66 (scale 0.0014088818758681283) ***** 
[1] xi(18)=0.999998092656 zeta(19)=0
Stats: nr=31 min=2 max=188 sum3=20651778
Safeguard: keep additional 1 states
Emax=8.02313585784 nrkept=406 nrkeptmult=1008 
Total energy=-2.88812006967  Egs=-1.2911701772
Kept: 406 out of 1506, ratio=0.27
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 20/66 (scale 0.0009962299283171772) ***** 
[1] xi(19)=0.999999046327 zeta(20)=0
Stats: nr=34 min=1 max=171 sum3=22079476
Safeguard: keep additional 4 states
Emax=8.00299707059 nrkept=402 nrkeptmult=1020 
Total energy=-2.88918222758  Egs=-1.0661774708
Kept: 402 out of 1528, ratio=0.263
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 21/66 (scale 0.00070444093793406415) ***** 
[1] xi(20)=0.999999523163 zeta(21)=0
Stats: nr=31 min=2 max=188 sum3=20811606
Safeguard: keep additional 1 states
Emax=8.03493346581 nrkept=406 nrkeptmult=1008 
Total energy=-2.89006289256  Egs=-1.25016156637
Kept: 406 out of 1518, ratio=0.267
Memory used: 15 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 22/66 (scale 0.0004981149641585886) ***** 
[1] xi(21)=0.999999761581 zeta(22)=0
Stats: nr=34 min=1 max=171 sum3=22079476
Safeguard: keep additional 3 states
Emax=8.01493751268 nrkept=406 nrkeptmult=1028 
Total energy=-2.89061431769  Egs=-1.10702382197
Kept: 406 out of 1528, ratio=0.266
Memory used: 15 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 23/66 (scale 0.00035222046896703208) ***** 
[1] xi(22)=0.999999880791 zeta(23)=0
Stats: nr=31 min=2 max=190 sum3=21399364
Safeguard: keep additional 1 states
Emax=8.04726543326 nrkept=407 nrkeptmult=1010 
Total energy=-2.89103723059  Egs=-1.20070505815
Kept: 407 out of 1534, ratio=0.265
Memory used: 15 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 24/66 (scale 0.0002490574820792943) ***** 
[1] xi(23)=0.999999940395 zeta(24)=0
Stats: nr=34 min=1 max=172 sum3=22398032
Safeguard: keep additional 1 states
Emax=8.02413748613 nrkept=404 nrkeptmult=1024 
Total energy=-2.89132560279  Egs=-1.15785400071
Kept: 404 out of 1532, ratio=0.264
Memory used: 15 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 25/66 (scale 0.00017611023448351604) ***** 
[1] xi(24)=0.999999970198 zeta(25)=0
Stats: nr=31 min=2 max=190 sum3=21305264
Safeguard: keep additional 1 states
Emax=8.05193088175 nrkept=407 nrkeptmult=1010 
Total energy=-2.89152671516  Egs=-1.14196866823
Kept: 407 out of 1526, ratio=0.267
Memory used: 15 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 26/66 (scale 0.00012452874103964715) ***** 
[1] xi(25)=0.999999985099 zeta(26)=0
Stats: nr=34 min=1 max=172 sum3=22398032
Safeguard: keep additional 1 states
Emax=8.00925846651 nrkept=395 nrkeptmult=1003 
Total energy=-2.89167866654  Egs=-1.22021125868
Kept: 395 out of 1532, ratio=0.258
Memory used: 16 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 27/66 (scale 8.8055117241758019e-05) ***** 
[1] xi(26)=0.999999992549 zeta(27)=0
Stats: nr=31 min=1 max=187 sum3=20461393
Emax=8.00478839756 nrkept=399 nrkeptmult=978 
Total energy=-2.89177331389  Egs=-1.07486488401
Kept: 399 out of 1495, ratio=0.267
Memory used: 16 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 28/66 (scale 6.2264370519823575e-05) ***** 
[1] xi(27)=0.999999996275 zeta(28)=0
Stats: nr=32 min=1 max=170 sum3=21605402
Emax=8.01734145363 nrkept=380 nrkeptmult=940 
Total energy=-2.89185386416  Egs=-1.29368162174
Kept: 380 out of 1502, ratio=0.253
Memory used: 16 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 29/66 (scale 4.402755862087901e-05) ***** 
[1] xi(28)=0.999999998137 zeta(29)=0
Stats: nr=31 min=1 max=185 sum3=19296607
Safeguard: keep additional 4 states
Emax=8.01794536475 nrkept=398 nrkeptmult=976 
Total energy=-2.89189806068  Egs=-1.0038376441
Kept: 398 out of 1435, ratio=0.277
Memory used: 16 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 30/66 (scale 3.1132185259911788e-05) ***** 
[1] xi(29)=0.999999999069 zeta(30)=0
Stats: nr=32 min=1 max=169 sum3=21294586
Safeguard: keep additional 1 states
Emax=8.05366971973 nrkept=368 nrkeptmult=892 
Total energy=-2.8919408188  Egs=-1.37343763549
Kept: 368 out of 1498, ratio=0.246
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 31/66 (scale 2.2013779310439505e-05) ***** 
[1] xi(30)=0.999999999534 zeta(31)=0
Stats: nr=31 min=1 max=183 sum3=18050959
Safeguard: keep additional 1 states
Emax=8.03003677652 nrkept=381 nrkeptmult=910 
Total energy=-2.89196145467  Egs=-0.937406996444
Kept: 381 out of 1387, ratio=0.275
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 32/66 (scale 1.5566092629955894e-05) ***** 
[1] xi(31)=0.999999999767 zeta(32)=0
Stats: nr=30 min=1 max=166 sum3=19665524
Safeguard: keep additional 1 states
Emax=8.00545173135 nrkept=337 nrkeptmult=791 
Total energy=-2.89198401311  Egs=-1.44920412876
Kept: 337 out of 1430, ratio=0.236
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 33/66 (scale 1.1006889655219752e-05) ***** 
[1] xi(32)=0.999999999884 zeta(33)=0
Stats: nr=31 min=1 max=175 sum3=14660886
Safeguard: keep additional 2 states
Emax=8.01699096943 nrkept=353 nrkeptmult=830 
Total energy=-2.89199374813  Egs=-0.884447341009
Kept: 353 out of 1266, ratio=0.279
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 34/66 (scale 7.7830463149779469e-06) ***** 
[1] xi(33)=0.999999999942 zeta(34)=0
Stats: nr=26 min=1 max=158 sum3=16468548
Safeguard: keep additional 2 states
Emax=8.06332967733 nrkept=315 nrkeptmult=729 
Total energy=-2.8920054994  Egs=-1.50985486209
Kept: 315 out of 1326, ratio=0.238
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 35/66 (scale 5.5034448276098762e-06) ***** 
[1] xi(34)=0.999999999971 zeta(35)=0
Stats: nr=31 min=1 max=165 sum3=12062162
Safeguard: keep additional 2 states
Emax=8.02845675733 nrkept=344 nrkeptmult=798 
Total energy=-2.89201016874  Egs=-0.848439255508
Kept: 344 out of 1178, ratio=0.292
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 36/66 (scale 3.8915231574889735e-06) ***** 
[1] xi(35)=0.999999999985 zeta(36)=0
Stats: nr=26 min=1 max=155 sum3=15532134
Emax=8.01173455528 nrkept=282 nrkeptmult=648 
Total energy=-2.89201620406  Egs=-1.55088877357
Kept: 282 out of 1290, ratio=0.219
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 37/66 (scale 2.7517224138049381e-06) ***** 
[1] xi(36)=0.999999999993 zeta(37)=0
Stats: nr=29 min=1 max=147 sum3=8613640
Safeguard: keep additional 1 states
Emax=8.00477723611 nrkept=313 nrkeptmult=728 
Total energy=-2.89201847924  Egs=-0.826821239181
Kept: 313 out of 1054, ratio=0.297
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 38/66 (scale 1.9457615787444867e-06) ***** 
[1] xi(37)=0.999999999996 zeta(38)=0
Stats: nr=26 min=1 max=140 sum3=11522648
Emax=8.08408626595 nrkept=263 nrkeptmult=593 
Total energy=-2.89202154442  Egs=-1.57531048655
Kept: 263 out of 1172, ratio=0.224
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 39/66 (scale 1.3758612069024691e-06) ***** 
[1] xi(38)=0.999999999998 zeta(39)=0
Stats: nr=29 min=1 max=139 sum3=7162570
Safeguard: keep additional 2 states
Emax=8.00538394087 nrkept=269 nrkeptmult=626 
Total energy=-2.89202266555  Egs=-0.814855799239
Kept: 269 out of 982, ratio=0.274
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 40/66 (scale 9.7288078937224336e-07) ***** 
[1] xi(39)=0.999999999999 zeta(40)=0
Stats: nr=26 min=1 max=122 sum3=7496382
Emax=8.16932308977 nrkept=258 nrkeptmult=578 
Total energy=-2.89202421118  Egs=-1.58871968894
Kept: 258 out of 1008, ratio=0.256
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 41/66 (scale 6.8793060345123453e-07) ***** 
[1] xi(40)=1 zeta(41)=0
Stats: nr=29 min=1 max=137 sum3=6825567
Safeguard: keep additional 1 states
Emax=8.0177675243 nrkept=239 nrkeptmult=534 
Total energy=-2.8920247674  Egs=-0.808540545245
Kept: 239 out of 963, ratio=0.248
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 42/66 (scale 4.8644039468612168e-07) ***** 
[1] xi(41)=1 zeta(42)=0
Stats: nr=25 min=2 max=111 sum3=5472026
Emax=8.39973129214 nrkept=258 nrkeptmult=578 
Total energy=-2.89202554364  Egs=-1.59575738262
Kept: 258 out of 890, ratio=0.29
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 43/66 (scale 3.4396530172561726e-07) ***** 
[1] xi(42)=1 zeta(43)=0
Stats: nr=29 min=1 max=137 sum3=6825567
Emax=8.12000322884 nrkept=237 nrkeptmult=524 
Total energy=-2.89202582063  Egs=-0.805293171994
Kept: 237 out of 963, ratio=0.246
Memory used: 16 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 44/66 (scale 2.4322019734306084e-07) ***** 
[1] xi(43)=1 zeta(44)=0
Stats: nr=25 min=2 max=111 sum3=5457822
Safeguard: keep additional 1 states
Emax=8.52087108663 nrkept=259 nrkeptmult=579 
Total energy=-2.89202620963  Egs=-1.59936409043
Kept: 259 out of 882, ratio=0.294
Memory used: 17 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 45/66 (scale 1.7198265086280863e-07) ***** 
[1] xi(44)=1 zeta(45)=0
Stats: nr=29 min=1 max=138 sum3=6955525
Emax=8.18439700783 nrkept=237 nrkeptmult=524 
Total energy=-2.89202634784  Egs=-0.803646086116
Kept: 237 out of 967, ratio=0.245
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 46/66 (scale 1.2161009867153042e-07) ***** 
[1] xi(45)=1 zeta(46)=0
Stats: nr=25 min=2 max=111 sum3=5457822
Safeguard: keep additional 1 states
Emax=8.53578924654 nrkept=259 nrkeptmult=579 
Total energy=-2.89202654257  Egs=-1.60119004413
Kept: 259 out of 882, ratio=0.294
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 47/66 (scale 8.5991325431404316e-08) ***** 
[1] xi(46)=1 zeta(47)=0
Stats: nr=29 min=1 max=138 sum3=6955525
Safeguard: keep additional 1 states
Emax=8.00061362251 nrkept=231 nrkeptmult=512 
Total energy=-2.8920266116  Egs=-0.802816587245
Kept: 231 out of 967, ratio=0.239
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 48/66 (scale 6.080504933576521e-08) ***** 
[1] xi(47)=1 zeta(48)=0
Stats: nr=25 min=2 max=108 sum3=5037416
Safeguard: keep additional 2 states
Emax=8.00282341482 nrkept=257 nrkeptmult=575 
Total energy=-2.89202670902  Egs=-1.60210873153
Kept: 257 out of 860, ratio=0.299
Memory used: 17 MB  Time elapsed: 4 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
Safeguard: keep additional 1 states
Emax=8.00632310431 nrkept=230 nrkeptmult=510 
Total energy=-2.89202674352  Egs=-0.802400333412
Kept: 230 out of 959, ratio=0.24
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 50/66 (scale 3.0402524667882605e-08) ***** 
[1] xi(49)=1 zeta(50)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Safeguard: keep additional 1 states
Emax=8.0014274022 nrkept=253 nrkeptmult=569 
Total energy=-2.89202679224  Egs=-1.60256951188
Kept: 253 out of 856, ratio=0.296
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 51/66 (scale 2.1497831357851079e-08) ***** 
[1] xi(50)=1 zeta(51)=0
Stats: nr=29 min=1 max=134 sum3=6409156
Safeguard: keep additional 1 states
Emax=8.00908995134 nrkept=230 nrkeptmult=510 
Total energy=-2.89202680948  Egs=-0.802191822975
Kept: 230 out of 946, ratio=0.243
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 52/66 (scale 1.5201262333941303e-08) ***** 
[1] xi(51)=1 zeta(52)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.00680386101 nrkept=252 nrkeptmult=568 
Total energy=-2.89202683385  Egs=-1.60280026104
Kept: 252 out of 856, ratio=0.294
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 53/66 (scale 1.0748915678925539e-08) ***** 
[1] xi(52)=1 zeta(53)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01046785522 nrkept=230 nrkeptmult=510 
Total energy=-2.89202684247  Egs=-0.80208743885
Kept: 230 out of 942, ratio=0.244
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 54/66 (scale 7.6006311669706513e-09) ***** 
[1] xi(53)=1 zeta(54)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.00893794701 nrkept=252 nrkeptmult=568 
Total energy=-2.89202685465  Egs=-1.60291570026
Kept: 252 out of 856, ratio=0.294
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 55/66 (scale 5.3744578394627697e-09) ***** 
[1] xi(54)=1 zeta(55)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01115537219 nrkept=230 nrkeptmult=510 
Total energy=-2.89202685896  Egs=-0.802035257766
Kept: 230 out of 942, ratio=0.244
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 56/66 (scale 3.8003155834853256e-09) ***** 
[1] xi(55)=1 zeta(56)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.01000496654 nrkept=252 nrkeptmult=568 
Total energy=-2.89202686506  Egs=-1.60297344106
Kept: 252 out of 856, ratio=0.294
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 57/66 (scale 2.6872289197313849e-09) ***** 
[1] xi(56)=1 zeta(57)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01149873836 nrkept=230 nrkeptmult=510 
Total energy=-2.89202686721  Egs=-0.802009161478
Kept: 230 out of 942, ratio=0.244
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 58/66 (scale 1.9001577917426628e-09) ***** 
[1] xi(57)=1 zeta(58)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.01053843386 nrkept=252 nrkeptmult=568 
Total energy=-2.89202687026  Egs=-1.60300231663
Kept: 252 out of 856, ratio=0.294
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 59/66 (scale 1.3436144598656924e-09) ***** 
[1] xi(58)=1 zeta(59)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01167032518 nrkept=230 nrkeptmult=510 
Total energy=-2.89202687133  Egs=-0.80199611199
Kept: 230 out of 942, ratio=0.244
Memory used: 17 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 60/66 (scale 9.5007889587133141e-10) ***** 
[1] xi(59)=1 zeta(60)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.01080515734 nrkept=252 nrkeptmult=568 
Total energy=-2.89202687286  Egs=-1.60301675561
Kept: 252 out of 856, ratio=0.294
Memory used: 18 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 61/66 (scale 6.7180722993284622e-10) ***** 
[1] xi(60)=1 zeta(61)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01175609568 nrkept=230 nrkeptmult=510 
Total energy=-2.8920268734  Egs=-0.801989586952
Kept: 230 out of 942, ratio=0.244
Memory used: 18 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 62/66 (scale 4.750394479356657e-10) ***** 
[1] xi(61)=1 zeta(62)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.01093851752 nrkept=252 nrkeptmult=568 
Total energy=-2.89202687416  Egs=-1.60302397534
Kept: 252 out of 856, ratio=0.294
Memory used: 18 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 63/66 (scale 3.3590361496642311e-10) ***** 
[1] xi(62)=1 zeta(63)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01179897533 nrkept=230 nrkeptmult=510 
Total energy=-2.89202687443  Egs=-0.801986324379
Kept: 230 out of 942, ratio=0.244
Memory used: 18 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 64/66 (scale 2.3751972396783285e-10) ***** 
[1] xi(63)=1 zeta(64)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.01100519721 nrkept=252 nrkeptmult=568 
Total energy=-2.89202687481  Egs=-1.60302758524
Kept: 252 out of 856, ratio=0.294
Memory used: 18 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 65/66 (scale 1.6795180748321155e-10) ***** 
[1] xi(64)=1 zeta(65)=0
Stats: nr=29 min=1 max=133 sum3=6287058
Safeguard: keep additional 1 states
Emax=8.01182041374 nrkept=230 nrkeptmult=510 
Total energy=-2.89202687494  Egs=-0.801984693089
Kept: 230 out of 942, ratio=0.244
Memory used: 18 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 66/66 (scale 1.1875986198391643e-10) ***** 
[1] xi(65)=1 zeta(66)=0
Stats: nr=25 min=2 max=107 sum3=4915474
Emax=8.01103853686 nrkept=252 nrkeptmult=568 
Total energy=-2.89202687513  Egs=-1.60302939019
Kept: 252 out of 856, ratio=0.294
Memory used: 18 MB  Time elapsed: 4 s

** Iteration completed.


Total energy:             -2.892026875133455
TKW=1.10543293501e-05
Grand canonical Z=              9.636193975307458
Zft (last shell)=                9.56323398095858

Memory usage report
===================
  after diag: 18856 kB
after recalc: 18856 kB
 after split: 18856 kB
  after trim: 18856 kB
 after trunc: 18856 kB
      diag_h: 18856 kB

Peak usage: 18856 kB

Timing report
=============
         All: 5 s
        diag: 3 s
    recalc f: 0 s
       Other: 1 s
