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=	0.003	 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
0.0380036996137 
(-1 2) 2 states
0.0178401161054 0.0562067668351 
(0 1) 3 states
0 0.0409157748445 0.0770163565706 
(0 3) 1 states
0.0360431833268 
(1 2) 2 states
0.0204088186285 0.0595196131728 
(2 1) 1 states
0.0438852484745 
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=3.03672490758 nrkept=35 nrkeptmult=64 
Total energy=-1.088268881  Egs=-1.46184713751
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=5.47169165786 nrkept=126 nrkeptmult=256 
Total energy=-1.38993275404  Egs=-0.59141693627
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 3 states
Emax=8.00252777119 nrkept=398 nrkeptmult=896 
Total energy=-1.92119070635  Egs=-1.47295980718
Kept: 398 out of 462, ratio=0.861
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=177 sum3=22480272
Emax=8.06693557656 nrkept=715 nrkeptmult=1698 
Total energy=-2.12147701535  Egs=-0.785329141682
Kept: 715 out of 1482, ratio=0.482
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=8.00679828174 nrkept=905 nrkeptmult=2174 
Total energy=-2.39325944802  Egs=-1.50708181548
Kept: 905 out of 2682, ratio=0.337
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=372 sum3=221848738
Emax=8.0319650346 nrkept=849 nrkeptmult=2018 
Total energy=-2.5022227439  Egs=-0.854497264989
Kept: 849 out of 3394, ratio=0.25
Memory used: 16 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=8.0032889615 nrkept=896 nrkeptmult=2156 
Total energy=-2.63748163742  Egs=-1.50006913097
Kept: 896 out of 3186, ratio=0.281
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=369 sum3=214772918
Emax=8.02932922577 nrkept=849 nrkeptmult=2018 
Total energy=-2.69416262407  Egs=-0.888991980025
Kept: 849 out of 3362, ratio=0.253
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=8.00538659512 nrkept=862 nrkeptmult=2069 
Total energy=-2.76073372034  Egs=-1.47659416576
Kept: 862 out of 3186, ratio=0.271
Memory used: 18 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=351 sum3=190646645
Emax=8.0411626219 nrkept=849 nrkeptmult=2018 
Total energy=-2.78995742554  Egs=-0.916696800232
Kept: 849 out of 3227, ratio=0.263
Memory used: 18 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=8.00030080876 nrkept=811 nrkeptmult=1951 
Total energy=-2.82255646507  Egs=-1.44613966959
Kept: 811 out of 3186, ratio=0.255
Memory used: 19 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** 
[1] xi(11)=0.999755933863 zeta(12)=0
Stats: nr=38 min=1 max=333 sum3=160748612
Emax=8.07134330834 nrkept=849 nrkeptmult=2018 
Total energy=-2.83760777208  Egs=-0.944266641585
Kept: 849 out of 3044, ratio=0.279
Memory used: 18 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=8.00222447359 nrkept=778 nrkeptmult=1863 
Total energy=-2.85352422316  Egs=-1.41215272845
Kept: 778 out of 3186, ratio=0.244
Memory used: 20 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** 
[1] xi(13)=0.9999389695 zeta(14)=0
Stats: nr=37 min=1 max=323 sum3=145612833
Emax=8.00036018463 nrkept=777 nrkeptmult=1851 
Total energy=-2.86127640719  Egs=-0.972690114977
Kept: 777 out of 2919, ratio=0.266
Memory used: 20 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** 
[1] xi(14)=0.999969483586 zeta(15)=0
Stats: nr=33 min=1 max=366 sum3=147983790
Emax=8.00077283543 nrkept=695 nrkeptmult=1669 
Total energy=-2.86903178679  Egs=-1.37615859184
Kept: 695 out of 2916, ratio=0.238
Memory used: 21 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 16/66 (scale 0.0039849197132687088) ***** 
[1] xi(15)=0.999984741502 zeta(16)=0
Stats: nr=37 min=1 max=297 sum3=104014733
Emax=8.00423622187 nrkept=742 nrkeptmult=1773 
Total energy=-2.87302514984  Egs=-1.00211882404
Kept: 742 out of 2609, ratio=0.284
Memory used: 20 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=350 sum3=129712460
Emax=8.00047762304 nrkept=635 nrkeptmult=1528 
Total energy=-2.87679660624  Egs=-1.3384572776
Kept: 635 out of 2786, ratio=0.228
Memory used: 20 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 18/66 (scale 0.0019924598566343544) ***** 
[1] xi(17)=0.999996185321 zeta(18)=0
Stats: nr=36 min=1 max=278 sum3=83430634
Emax=8.00658570588 nrkept=597 nrkeptmult=1436 
Total energy=-2.87885586504  Egs=-1.03352586607
Kept: 597 out of 2386, ratio=0.25
Memory used: 21 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=287 sum3=70590748
Emax=8.00407709397 nrkept=545 nrkeptmult=1328 
Total energy=-2.88068457076  Egs=-1.29798370527
Kept: 545 out of 2242, ratio=0.243
Memory used: 21 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=245 sum3=54231389
Emax=8.00170979987 nrkept=523 nrkeptmult=1286 
Total energy=-2.88174968901  Egs=-1.06914901551
Kept: 523 out of 2051, ratio=0.255
Memory used: 21 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 21/66 (scale 0.00070444093793406415) ***** 
[1] xi(20)=0.999999523163 zeta(21)=0
Stats: nr=32 min=1 max=250 sum3=47457962
Emax=8.00595371574 nrkept=488 nrkeptmult=1195 
Total energy=-2.88263206939  Egs=-1.25259669059
Kept: 488 out of 1970, ratio=0.248
Memory used: 21 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 22/66 (scale 0.0004981149641585886) ***** 
[1] xi(21)=0.999999761581 zeta(22)=0
Stats: nr=35 min=1 max=217 sum3=39102084
Emax=8.00063739903 nrkept=457 nrkeptmult=1135 
Total energy=-2.88318593375  Egs=-1.11192073126
Kept: 457 out of 1836, ratio=0.249
Memory used: 21 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 23/66 (scale 0.00035222046896703208) ***** 
[1] xi(22)=0.999999880791 zeta(23)=0
Stats: nr=32 min=1 max=216 sum3=30822877
Emax=8.00594886628 nrkept=445 nrkeptmult=1099 
Total energy=-2.88360860034  Egs=-1.20000576565
Kept: 445 out of 1723, ratio=0.258
Memory used: 21 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 24/66 (scale 0.0002490574820792943) ***** 
[1] xi(23)=0.999999940395 zeta(24)=0
Stats: nr=35 min=1 max=195 sum3=29331242
Emax=8.00152616187 nrkept=426 nrkeptmult=1070 
Total energy=-2.88389864335  Egs=-1.16456249246
Kept: 426 out of 1676, ratio=0.254
Memory used: 21 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=200 sum3=24987720
Emax=8.00272565352 nrkept=427 nrkeptmult=1055 
Total energy=-2.88409920851  Egs=-1.13886146679
Kept: 427 out of 1608, ratio=0.266
Memory used: 21 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=184 sum3=25496994
Emax=8.01000122394 nrkept=413 nrkeptmult=1037 
Total energy=-2.88425222641  Egs=-1.22877583405
Kept: 413 out of 1608, ratio=0.257
Memory used: 21 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=1 max=194 sum3=23119062
Emax=8.00102939977 nrkept=414 nrkeptmult=1016 
Total energy=-2.88434645246  Egs=-1.07008035696
Kept: 414 out of 1560, ratio=0.265
Memory used: 21 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 28/66 (scale 6.2264370519823575e-05) ***** 
[1] xi(27)=0.999999996275 zeta(28)=0
Stats: nr=33 min=1 max=181 sum3=23880365
Emax=8.00229860225 nrkept=390 nrkeptmult=956 
Total energy=-2.88442763253  Egs=-1.30379639887
Kept: 390 out of 1559, ratio=0.25
Memory used: 21 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 29/66 (scale 4.402755862087901e-05) ***** 
[1] xi(28)=0.999999998137 zeta(29)=0
Stats: nr=31 min=1 max=189 sum3=20515015
Emax=8.0045442297 nrkept=401 nrkeptmult=973 
Total energy=-2.88447159335  Egs=-0.99848418833
Kept: 401 out of 1471, ratio=0.273
Memory used: 21 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 30/66 (scale 3.1132185259911788e-05) ***** 
[1] xi(29)=0.999999999069 zeta(30)=0
Stats: nr=32 min=1 max=174 sum3=21817213
Emax=8.01708338588 nrkept=362 nrkeptmult=867 
Total energy=-2.884514683  Egs=-1.38408707483
Kept: 362 out of 1507, ratio=0.24
Memory used: 21 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 31/66 (scale 2.2013779310439505e-05) ***** 
[1] xi(30)=0.999999999534 zeta(31)=0
Stats: nr=31 min=1 max=181 sum3=17241431
Emax=8.02258045048 nrkept=382 nrkeptmult=916 
Total energy=-2.88453521883  Egs=-0.932862531652
Kept: 382 out of 1361, ratio=0.281
Memory used: 21 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 32/66 (scale 1.5566092629955894e-05) ***** 
[1] xi(31)=0.999999999767 zeta(32)=0
Stats: nr=30 min=1 max=169 sum3=19363867
Emax=8.00049823291 nrkept=339 nrkeptmult=801 
Total energy=-2.88455792748  Egs=-1.45885357061
Kept: 339 out of 1435, ratio=0.236
Memory used: 21 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=173 sum3=14559336
Emax=8.00293141618 nrkept=355 nrkeptmult=828 
Total energy=-2.88456777692  Egs=-0.894843266127
Kept: 355 out of 1272, ratio=0.279
Memory used: 21 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 34/66 (scale 7.7830463149779469e-06) ***** 
[1] xi(33)=0.999999999942 zeta(34)=0
Stats: nr=29 min=1 max=161 sum3=16401790
Emax=8.01783542659 nrkept=309 nrkeptmult=717 
Total energy=-2.8845794418  Egs=-1.49875479585
Kept: 309 out of 1330, ratio=0.232
Memory used: 21 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 35/66 (scale 5.5034448276098762e-06) ***** 
[1] xi(34)=0.999999999971 zeta(35)=0
Stats: nr=30 min=1 max=160 sum3=11240057
Emax=8.0003628959 nrkept=327 nrkeptmult=757 
Total energy=-2.88458434093  Egs=-0.890193403228
Kept: 327 out of 1157, ratio=0.283
Memory used: 21 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 36/66 (scale 3.8915231574889735e-06) ***** 
[1] xi(35)=0.999999999985 zeta(36)=0
Stats: nr=27 min=1 max=153 sum3=13301934
Emax=8.01169510813 nrkept=280 nrkeptmult=644 
Total energy=-2.88459016212  Egs=-1.49586390115
Kept: 280 out of 1224, ratio=0.229
Memory used: 21 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 37/66 (scale 2.7517224138049381e-06) ***** 
[1] xi(36)=0.999999999993 zeta(37)=0
Stats: nr=29 min=1 max=145 sum3=8411787
Emax=8.0025515535 nrkept=301 nrkeptmult=693 
Total energy=-2.8845926038  Egs=-0.887328527049
Kept: 301 out of 1047, ratio=0.287
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 38/66 (scale 1.9457615787444867e-06) ***** 
[1] xi(37)=0.999999999996 zeta(38)=0
Stats: nr=27 min=1 max=143 sum3=10176867
Emax=8.00717596903 nrkept=257 nrkeptmult=577 
Total energy=-2.88459551097  Egs=-1.49410419051
Kept: 257 out of 1125, ratio=0.228
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 39/66 (scale 1.3758612069024691e-06) ***** 
[1] xi(38)=0.999999999998 zeta(39)=0
Stats: nr=29 min=1 max=138 sum3=6912922
Emax=8.01258807706 nrkept=271 nrkeptmult=612 
Total energy=-2.88459672957  Egs=-0.885699889933
Kept: 271 out of 958, ratio=0.283
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 40/66 (scale 9.7288078937224336e-07) ***** 
[1] xi(39)=0.999999999999 zeta(40)=0
Stats: nr=27 min=1 max=128 sum3=7275213
Emax=8.00601941973 nrkept=249 nrkeptmult=559 
Total energy=-2.8845981822  Egs=-1.49311897815
Kept: 249 out of 1011, ratio=0.246
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 41/66 (scale 6.8793060345123453e-07) ***** 
[1] xi(40)=1 zeta(41)=0
Stats: nr=29 min=1 max=132 sum3=6183136
Emax=8.00086236068 nrkept=251 nrkeptmult=558 
Total energy=-2.8845987909  Egs=-0.884823886989
Kept: 251 out of 928, ratio=0.27
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 42/66 (scale 4.8644039468612168e-07) ***** 
[1] xi(41)=1 zeta(42)=0
Stats: nr=26 min=1 max=117 sum3=5783314
Emax=8.00404657785 nrkept=241 nrkeptmult=538 
Total energy=-2.88459951696  Egs=-1.49259510433
Kept: 241 out of 934, ratio=0.258
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 43/66 (scale 3.4396530172561726e-07) ***** 
[1] xi(42)=1 zeta(43)=0
Stats: nr=29 min=1 max=129 sum3=5672133
Emax=8.01299344848 nrkept=245 nrkeptmult=541 
Total energy=-2.88459982115  Egs=-0.884368352259
Kept: 245 out of 897, ratio=0.273
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 44/66 (scale 2.4322019734306084e-07) ***** 
[1] xi(43)=1 zeta(44)=0
Stats: nr=26 min=1 max=113 sum3=5381369
Emax=8.04180466318 nrkept=241 nrkeptmult=537 
Total energy=-2.88460018411  Egs=-1.49232456349
Kept: 241 out of 911, ratio=0.265
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 45/66 (scale 1.7198265086280863e-07) ***** 
[1] xi(44)=1 zeta(45)=0
Stats: nr=29 min=1 max=129 sum3=5677785
Emax=8.00013273927 nrkept=242 nrkeptmult=533 
Total energy=-2.88460033617  Egs=-0.884135888671
Kept: 242 out of 897, ratio=0.27
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 46/66 (scale 1.2161009867153042e-07) ***** 
[1] xi(45)=1 zeta(46)=0
Stats: nr=26 min=1 max=112 sum3=5232636
Emax=8.00253863116 nrkept=240 nrkeptmult=534 
Total energy=-2.88460051763  Egs=-1.49218703077
Kept: 240 out of 900, ratio=0.267
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 47/66 (scale 8.5991325431404316e-08) ***** 
[1] xi(46)=1 zeta(47)=0
Stats: nr=29 min=1 max=129 sum3=5640779
Emax=8.00467841306 nrkept=238 nrkeptmult=526 
Total energy=-2.88460059365  Egs=-0.884018441972
Kept: 238 out of 893, ratio=0.267
Memory used: 22 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 48/66 (scale 6.080504933576521e-08) ***** 
[1] xi(47)=1 zeta(48)=0
Stats: nr=26 min=1 max=109 sum3=5030133
Emax=8.00227942866 nrkept=239 nrkeptmult=533 
Total energy=-2.88460068438  Egs=-1.49211767752
Kept: 239 out of 885, ratio=0.27
Memory used: 22 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=128 sum3=5551754
Emax=8.00826646858 nrkept=237 nrkeptmult=522 
Total energy=-2.88460072239  Egs=-0.883959408666
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 50/66 (scale 3.0402524667882605e-08) ***** 
[1] xi(49)=1 zeta(50)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01018769925 nrkept=239 nrkeptmult=533 
Total energy=-2.88460076775  Egs=-1.49208285135
Kept: 239 out of 881, ratio=0.271
Memory used: 22 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=128 sum3=5551754
Emax=8.0100543465 nrkept=237 nrkeptmult=522 
Total energy=-2.88460078675  Egs=-0.883929819122
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 52/66 (scale 1.5201262333941303e-08) ***** 
[1] xi(51)=1 zeta(52)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01414240566 nrkept=239 nrkeptmult=533 
Total energy=-2.88460080943  Egs=-1.49206539512
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 53/66 (scale 1.0748915678925539e-08) ***** 
[1] xi(52)=1 zeta(53)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01094670168 nrkept=237 nrkeptmult=522 
Total energy=-2.88460081893  Egs=-0.883915009612
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 54/66 (scale 7.6006311669706513e-09) ***** 
[1] xi(53)=1 zeta(54)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01611946592 nrkept=239 nrkeptmult=533 
Total energy=-2.88460083027  Egs=-1.49205665142
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 55/66 (scale 5.3744578394627697e-09) ***** 
[1] xi(54)=1 zeta(55)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01139250645 nrkept=237 nrkeptmult=522 
Total energy=-2.88460083502  Egs=-0.88390760484
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 56/66 (scale 3.8003155834853256e-09) ***** 
[1] xi(55)=1 zeta(56)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01710798213 nrkept=239 nrkeptmult=533 
Total energy=-2.88460084069  Egs=-1.49205227093
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 57/66 (scale 2.6872289197313849e-09) ***** 
[1] xi(56)=1 zeta(57)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01161530706 nrkept=237 nrkeptmult=522 
Total energy=-2.88460084307  Egs=-0.883903906103
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 58/66 (scale 1.9001577917426628e-09) ***** 
[1] xi(57)=1 zeta(58)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01760223608 nrkept=239 nrkeptmult=533 
Total energy=-2.8846008459  Egs=-1.4920500738
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 59/66 (scale 1.3436144598656924e-09) ***** 
[1] xi(58)=1 zeta(59)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01172667185 nrkept=237 nrkeptmult=522 
Total energy=-2.88460084709  Egs=-0.883902061289
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 60/66 (scale 9.5007889587133141e-10) ***** 
[1] xi(59)=1 zeta(60)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01784936189 nrkept=239 nrkeptmult=533 
Total energy=-2.88460084851  Egs=-1.49204896879
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 61/66 (scale 6.7180722993284622e-10) ***** 
[1] xi(60)=1 zeta(61)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01178233533 nrkept=237 nrkeptmult=522 
Total energy=-2.8846008491  Egs=-0.883901143658
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 62/66 (scale 4.750394479356657e-10) ***** 
[1] xi(61)=1 zeta(62)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01797292476 nrkept=239 nrkeptmult=533 
Total energy=-2.88460084981  Egs=-1.49204840996
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 63/66 (scale 3.3590361496642311e-10) ***** 
[1] xi(62)=1 zeta(63)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01181015237 nrkept=237 nrkeptmult=522 
Total energy=-2.88460085011  Egs=-0.88390068967
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 64/66 (scale 2.3751972396783285e-10) ***** 
[1] xi(63)=1 zeta(64)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01803470662 nrkept=239 nrkeptmult=533 
Total energy=-2.88460085046  Egs=-1.49204812425
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 65/66 (scale 1.6795180748321155e-10) ***** 
[1] xi(64)=1 zeta(65)=0
Stats: nr=29 min=1 max=128 sum3=5551754
Emax=8.01182404731 nrkept=237 nrkeptmult=522 
Total energy=-2.88460085061  Egs=-0.883900467515
Kept: 237 out of 890, ratio=0.266
Memory used: 22 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 66/66 (scale 1.1875986198391643e-10) ***** 
[1] xi(65)=1 zeta(66)=0
Stats: nr=26 min=1 max=109 sum3=5013899
Emax=8.01806559816 nrkept=239 nrkeptmult=533 
Total energy=-2.88460085079  Egs=-1.4920479751
Kept: 239 out of 881, ratio=0.271
Memory used: 22 MB  Time elapsed: 10 s

** Iteration completed.


Total energy:              -2.88460085078969
TKW=1.20392617126e-05
Grand canonical Z=              9.683255201994632
Zft (last shell)=                9.59899153712043

Memory usage report
===================
  after diag: 26184 kB
after recalc: 23332 kB
 after split: 26956 kB
  after trim: 23332 kB
 after trunc: 26184 kB
      diag_h: 26184 kB

Peak usage: 26956 kB

Timing report
=============
         All: 10 s
        diag: 8 s
       Other: 2 s
