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 17:57:13

Parallelization using MPI: Running on 1 processors.

Using Intel MKL library 10.3.9
Processor optimization: Intel(R) Core(TM) i7 Processor
max_threads=8 blas_max_threads=8 dynamic=1

workdir=.
Tmin=1e-10 -> Nmax=66
TEMPERATURE T=1.41230072848e-10
Nmax=66
Tmin=1e-10
Ninit=0
Lambda=2
strategy=kept
lastall=0
lastalloverride=0
z=0.75
discretization=Z
band=flat
betabar=1
T=1.41230072848e-10
T_ratio=1
Tmin_ratio=-999
keep=5000
keepenergy=10
keepmin=0
keepblock=0
keepzrescale=0
log=
logall=0
logenumber=10
smooth=old
alpha=0.3
omega0=-1
omega0_ratio=1
brcut=0
loggauss_b=0.3
gauss_b=0.1
limitLL=0
eta=0
finite=0
bins=100
discard_trim=1e-16
discard_immediately=1e-16
NN1=0
NN2even=1
NN2avg=0
NNtanh=0
goodE=2
savebins=0
broaden=1
broaden_max=2.5
broaden_min=-99
broaden_min_ratio=3
broaden_ratio=1.05
dumpenergies=0
saveall=0
dumpannotated=0
dumpscaled=1
dumpabs=0
dumpprecision=8
dumpgroups=1
grouptol=1e-06
dumpdiagonal=0
ops=
specs=
specd=
spect=
specb=
reim=0
trsq=
specgt=
gtp=0.7
speci1t=
speci2t=
speckubo=
kubop=0.7
kubor=4
kubob=2
cond=
specchit=
chitp=1
chitp_ratio=-999
dm=0
T0opt=-1
dmnrg=0
cfs=0
fdm=0
fdmexpv=0
fdmexpvn=0
mats=0
nromegan=100
width_td=12
width_custom=12
prec_td=6
prec_custom=6
prec_xy=6
safeguard=1e-05
safeguardmax=200
fixeps=1e-15
diag=dsyev
diagratio=1
dsyevrlimit=100
restart=1
restartfactor=2
checkdiag=0
checkrho=0
calc0=1
tdht=0
spin=2
tri=old
preccpp=2000
checksumrules=0
showEs=0
globalB=0
globalBx=0
polarized=0
pol2x2=0
mpi=1
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=	0.004	 t=	0.
>> 
>>  Gamma^(1/2)=	0.019544100476116797
>>  Lambda=	2.	 BAND=	flat
>>  DISCRETIZATION=	Z	 z=	0.75
>>  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=0.75
# keep=5000 keepenergy=10 Nmax=66 channels=1 dots=1 betabar=1

Number of invariant subspaces: 6
(-2 1) 1 states
0.0311975261036 
(-1 2) 2 states
0.0146699919392 0.0469007647092 
(0 1) 3 states
0 0.0344520027024 0.0649106445206 
(0 3) 1 states
0.0303732305448 
(1 2) 2 states
0.0175509259851 0.0506141951342 
(2 1) 1 states
0.0377918905746 
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 0.85783160370214839) ***** 
[1] xi(0)=0.684778584642 zeta(1)=0
Stats: nr=10 min=1 max=8 sum3=1055
Emax=2.75110374104 nrkept=35 nrkeptmult=64 
Total energy=-1.17149404153  Egs=-1.32735438597
Kept: 35 out of 35, ratio=1
Memory used: 10 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/66 (scale 0.6065785440939202) ***** 
[1] xi(1)=0.833755393818 zeta(2)=0
Stats: nr=15 min=1 max=20 sum3=30066
Emax=5.19799194352 nrkept=126 nrkeptmult=256 
Total energy=-1.56993528407  Egs=-0.656866693397
Kept: 126 out of 126, ratio=1
Memory used: 11 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/66 (scale 0.4289158018510742) ***** 
[1] xi(2)=0.947046165312 zeta(3)=0
Stats: nr=21 min=1 max=75 sum3=1007202
Emax=10.4020647428 nrkept=460 nrkeptmult=1022 
Total energy=-2.22679090409  Egs=-1.53143254965
Kept: 460 out of 462, ratio=0.996
Memory used: 13 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/66 (scale 0.3032892720469601) ***** 
[1] xi(3)=0.972572268687 zeta(4)=0
Stats: nr=28 min=1 max=209 sum3=36715794
Emax=10.7289364786 nrkept=1259 nrkeptmult=3043 
Total energy=-2.47293810765  Egs=-0.811592186879
Kept: 1259 out of 1710, ratio=0.736
Memory used: 21 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/66 (scale 0.2144579009255371) ***** 
[1] xi(4)=0.980132362648 zeta(5)=0
Stats: nr=36 min=1 max=561 sum3=560127451
Safeguard: keep additional 1 states
Emax=10.4274625706 nrkept=1724 nrkeptmult=4270 
Total energy=-2.79864664201  Egs=-1.51875278532
Kept: 1724 out of 4729, ratio=0.365
Memory used: 30 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 6/66 (scale 0.15164463602348005) ***** 
[1] xi(5)=0.988164304343 zeta(6)=0
Stats: nr=42 min=1 max=665 sum3=1346911634
Emax=10.7077664103 nrkept=2121 nrkeptmult=5282 
Total energy=-2.92824987272  Egs=-0.854650939898
Kept: 2121 out of 6494, ratio=0.327
Memory used: 38 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 7/66 (scale 0.10722895046276855) ***** 
[1] xi(6)=0.993732382824 zeta(7)=0
Stats: nr=44 min=1 max=909 sum3=2511208935
Safeguard: keep additional 1 states
Emax=10.0172896423 nrkept=1788 nrkeptmult=4408 
Total energy=-3.08970977859  Egs=-1.5057491953
Kept: 1788 out of 8001, ratio=0.223
Memory used: 40 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 8/66 (scale 0.075822318011740025) ***** 
[1] xi(7)=0.996801670793 zeta(8)=0
Stats: nr=42 min=1 max=706 sum3=1555379913
Emax=10.0007802644 nrkept=2019 nrkeptmult=5018 
Total energy=-3.15696848278  Egs=-0.887056818592
Kept: 2019 out of 6735, ratio=0.3
Memory used: 43 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 9/66 (scale 0.053614475231384275) ***** 
[1] xi(8)=0.998386814476 zeta(9)=0
Stats: nr=44 min=1 max=867 sum3=2173598327
Emax=10.0000930551 nrkept=1749 nrkeptmult=4326 
Total energy=-3.23632677762  Egs=-1.48016546831
Kept: 1749 out of 7613, ratio=0.23
Memory used: 44 MB  Time elapsed: 10 s

 ***** [NRG] Iteration 10/66 (scale 0.037911159005870013) ***** 
[1] xi(9)=0.999190082691 zeta(10)=0
Stats: nr=42 min=1 max=688 sum3=1448255182
Emax=10.0090628014 nrkept=1905 nrkeptmult=4723 
Total energy=-3.27109053337  Egs=-0.916979503106
Kept: 1905 out of 6592, ratio=0.289
Memory used: 45 MB  Time elapsed: 11 s

 ***** [NRG] Iteration 11/66 (scale 0.026807237615692137) ***** 
[1] xi(10)=0.999594228576 zeta(11)=0
Stats: nr=43 min=1 max=824 sum3=1851658007
Emax=10.0036207586 nrkept=1661 nrkeptmult=4115 
Total energy=-3.30984032426  Egs=-1.44549734826
Kept: 1661 out of 7181, ratio=0.231
Memory used: 46 MB  Time elapsed: 14 s

 ***** [NRG] Iteration 12/66 (scale 0.018955579502935006) ***** 
[1] xi(11)=0.999796913201 zeta(12)=0
Stats: nr=42 min=1 max=652 sum3=1245933922
Safeguard: keep additional 1 states
Emax=10.0152101818 nrkept=1806 nrkeptmult=4488 
Total energy=-3.32786437941  Egs=-0.950857511254
Kept: 1806 out of 6268, ratio=0.288
Memory used: 49 MB  Time elapsed: 15 s

 ***** [NRG] Iteration 13/66 (scale 0.013403618807846069) ***** 
[1] xi(12)=0.999898406582 zeta(13)=0
Stats: nr=43 min=1 max=785 sum3=1592328331
Emax=10.0002789531 nrkept=1554 nrkeptmult=3831 
Total energy=-3.34666831593  Egs=-1.4028999773
Kept: 1554 out of 6805, ratio=0.228
Memory used: 49 MB  Time elapsed: 17 s

 ***** [NRG] Iteration 14/66 (scale 0.0094777897514675032) ***** 
[1] xi(13)=0.999949190818 zeta(14)=0
Stats: nr=42 min=1 max=613 sum3=1029872185
Emax=10.0024447975 nrkept=1623 nrkeptmult=3965 
Total energy=-3.35606228915  Egs=-0.991156531721
Kept: 1623 out of 5857, ratio=0.277
Memory used: 50 MB  Time elapsed: 19 s

 ***** [NRG] Iteration 15/66 (scale 0.0067018094039230343) ***** 
[1] xi(14)=0.999974592294 zeta(15)=0
Stats: nr=38 min=1 max=717 sum3=1189865763
Emax=10.0004723783 nrkept=1433 nrkeptmult=3536 
Total energy=-3.36512424588  Egs=-1.35216568868
Kept: 1433 out of 6105, ratio=0.235
Memory used: 50 MB  Time elapsed: 21 s

 ***** [NRG] Iteration 16/66 (scale 0.0047388948757337516) ***** 
[1] xi(15)=0.999987295369 zeta(16)=0
Stats: nr=41 min=1 max=578 sum3=817134062
Emax=10.0004092723 nrkept=1435 nrkeptmult=3532 
Total energy=-3.37004934862  Egs=-1.03929352169
Kept: 1435 out of 5396, ratio=0.266
Memory used: 51 MB  Time elapsed: 22 s

 ***** [NRG] Iteration 17/66 (scale 0.0033509047019615172) ***** 
[1] xi(16)=0.99999364749 zeta(17)=0
Stats: nr=37 min=1 max=638 sum3=837873815
Emax=10.0026022609 nrkept=1319 nrkeptmult=3258 
Total energy=-3.37438209227  Egs=-1.29300712273
Kept: 1319 out of 5405, ratio=0.244
Memory used: 54 MB  Time elapsed: 23 s

 ***** [NRG] Iteration 18/66 (scale 0.0023694474378668758) ***** 
[1] xi(17)=0.999996823696 zeta(18)=0
Stats: nr=41 min=1 max=540 sum3=646484415
Emax=10.0014194015 nrkept=1276 nrkeptmult=3113 
Total energy=-3.37697984753  Egs=-1.09635487984
Kept: 1276 out of 4971, ratio=0.257
Memory used: 54 MB  Time elapsed: 24 s

 ***** [NRG] Iteration 19/66 (scale 0.0016754523509807586) ***** 
[1] xi(18)=0.999998411836 zeta(19)=0
Stats: nr=35 min=1 max=576 sum3=608650178
Emax=10.0036346613 nrkept=1188 nrkeptmult=2960 
Total energy=-3.37903300536  Egs=-1.22543492623
Kept: 1188 out of 4802, ratio=0.247
Memory used: 54 MB  Time elapsed: 25 s

 ***** [NRG] Iteration 20/66 (scale 0.0011847237189334379) ***** 
[1] xi(19)=0.999999205915 zeta(20)=0
Stats: nr=40 min=1 max=498 sum3=475639519
Emax=10.0014491906 nrkept=1085 nrkeptmult=2668 
Total energy=-3.38041137668  Egs=-1.1634538082
Kept: 1085 out of 4477, ratio=0.242
Memory used: 54 MB  Time elapsed: 26 s

 ***** [NRG] Iteration 21/66 (scale 0.00083772617549037929) ***** 
[1] xi(20)=0.999999602957 zeta(21)=0
Stats: nr=35 min=1 max=492 sum3=382908686
Emax=10.0010316093 nrkept=1055 nrkeptmult=2657 
Total energy=-3.38137488375  Egs=-1.15014559676
Kept: 1055 out of 4088, ratio=0.258
Memory used: 56 MB  Time elapsed: 26 s

 ***** [NRG] Iteration 22/66 (scale 0.00059236185946671895) ***** 
[1] xi(21)=0.999999801478 zeta(22)=0
Stats: nr=40 min=1 max=447 sum3=342351208
Emax=10.0005886137 nrkept=984 nrkeptmult=2442 
Total energy=-3.38211014813  Egs=-1.24124192768
Kept: 984 out of 3982, ratio=0.247
Memory used: 56 MB  Time elapsed: 27 s

 ***** [NRG] Iteration 23/66 (scale 0.00041886308774518965) ***** 
[1] xi(22)=0.999999900739 zeta(23)=0
Stats: nr=34 min=1 max=446 sum3=287604699
Emax=10.0010504961 nrkept=955 nrkeptmult=2396 
Total energy=-3.38255836506  Egs=-1.07007980569
Kept: 955 out of 3711, ratio=0.257
Memory used: 59 MB  Time elapsed: 27 s

 ***** [NRG] Iteration 24/66 (scale 0.00029618092973335947) ***** 
[1] xi(23)=0.99999995037 zeta(24)=0
Stats: nr=39 min=1 max=407 sum3=256820999
Emax=10.0012366974 nrkept=870 nrkeptmult=2166 
Total energy=-3.38295151899  Egs=-1.32741136292
Kept: 870 out of 3605, ratio=0.241
Memory used: 59 MB  Time elapsed: 28 s

 ***** [NRG] Iteration 25/66 (scale 0.00020943154387259482) ***** 
[1] xi(24)=0.999999975185 zeta(25)=0
Stats: nr=34 min=1 max=398 sum3=200852250
Emax=10.0079976154 nrkept=852 nrkeptmult=2125 
Total energy=-3.3831695946  Egs=-1.04127392823
Kept: 852 out of 3282, ratio=0.26
Memory used: 60 MB  Time elapsed: 28 s

 ***** [NRG] Iteration 26/66 (scale 0.00014809046486667974) ***** 
[1] xi(25)=0.999999987592 zeta(26)=0
Stats: nr=37 min=1 max=367 sum3=189112535
Emax=10.0012893947 nrkept=774 nrkeptmult=1912 
Total energy=-3.38336870696  Egs=-1.34453196684
Kept: 774 out of 3215, ratio=0.241
Memory used: 59 MB  Time elapsed: 29 s

 ***** [NRG] Iteration 27/66 (scale 0.00010471577193629741) ***** 
[1] xi(26)=0.999999993796 zeta(27)=0
Stats: nr=33 min=1 max=356 sum3=143371808
Emax=10.0040751378 nrkept=758 nrkeptmult=1871 
Total energy=-3.38347630062  Egs=-1.0274828229
Kept: 758 out of 2918, ratio=0.26
Memory used: 59 MB  Time elapsed: 29 s

 ***** [NRG] Iteration 28/66 (scale 7.4045232433339868e-05) ***** 
[1] xi(27)=0.999999996898 zeta(28)=0
Stats: nr=37 min=1 max=330 sum3=136447453
Emax=10.009640525 nrkept=689 nrkeptmult=1672 
Total energy=-3.38357591326  Egs=-1.34529444725
Kept: 689 out of 2857, ratio=0.241
Memory used: 59 MB  Time elapsed: 29 s

 ***** [NRG] Iteration 29/66 (scale 5.2357885968148706e-05) ***** 
[1] xi(28)=0.999999998449 zeta(29)=0
Stats: nr=33 min=1 max=323 sum3=104795815
Emax=10.0043692375 nrkept=679 nrkeptmult=1649 
Total energy=-3.38362926528  Egs=-1.01898734168
Kept: 679 out of 2593, ratio=0.262
Memory used: 60 MB  Time elapsed: 29 s

 ***** [NRG] Iteration 30/66 (scale 3.7022616216669934e-05) ***** 
[1] xi(29)=0.999999999225 zeta(30)=0
Stats: nr=37 min=1 max=300 sum3=100081810
Emax=10.0024297324 nrkept=615 nrkeptmult=1479 
Total energy=-3.38367902241  Egs=-1.34396577405
Kept: 615 out of 2554, ratio=0.241
Memory used: 62 MB  Time elapsed: 30 s

 ***** [NRG] Iteration 31/66 (scale 2.6178942984074353e-05) ***** 
[1] xi(30)=0.999999999612 zeta(31)=0
Stats: nr=32 min=2 max=291 sum3=75773838
Emax=10.0069947962 nrkept=601 nrkeptmult=1434 
Total energy=-3.3837055677  Egs=-1.0139941161
Kept: 601 out of 2310, ratio=0.26
Memory used: 62 MB  Time elapsed: 30 s

 ***** [NRG] Iteration 32/66 (scale 1.8511308108334967e-05) ***** 
[1] xi(31)=0.999999999806 zeta(32)=0
Stats: nr=35 min=1 max=267 sum3=70675842
Emax=10.0003529782 nrkept=550 nrkeptmult=1296 
Total energy=-3.38373041902  Egs=-1.34249379764
Kept: 550 out of 2256, ratio=0.244
Memory used: 63 MB  Time elapsed: 30 s

 ***** [NRG] Iteration 33/66 (scale 1.3089471492037176e-05) ***** 
[1] xi(32)=0.999999999903 zeta(33)=0
Stats: nr=32 min=1 max=266 sum3=56077373
Emax=10.0040172623 nrkept=548 nrkeptmult=1286 
Total energy=-3.38374365516  Egs=-1.01120488933
Kept: 548 out of 2063, ratio=0.266
Memory used: 63 MB  Time elapsed: 30 s

 ***** [NRG] Iteration 34/66 (scale 9.2556540541674836e-06) ***** 
[1] xi(33)=0.999999999952 zeta(34)=0
Stats: nr=33 min=1 max=248 sum3=55848889
Emax=10.0016422359 nrkept=514 nrkeptmult=1198 
Total energy=-3.38375607117  Egs=-1.3414515089
Kept: 514 out of 2053, ratio=0.25
Memory used: 64 MB  Time elapsed: 30 s

 ***** [NRG] Iteration 35/66 (scale 6.5447357460185882e-06) ***** 
[1] xi(34)=0.999999999976 zeta(35)=0
Stats: nr=32 min=1 max=252 sum3=46937716
Emax=10.0032145591 nrkept=516 nrkeptmult=1198 
Total energy=-3.38376267947  Egs=-1.00971205159
Kept: 516 out of 1924, ratio=0.268
Memory used: 64 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 36/66 (scale 4.6278270270837418e-06) ***** 
[1] xi(35)=0.999999999988 zeta(36)=0
Stats: nr=32 min=1 max=242 sum3=48594442
Emax=10.0044635706 nrkept=479 nrkeptmult=1112 
Total energy=-3.38376888461  Egs=-1.34083168571
Kept: 479 out of 1930, ratio=0.248
Memory used: 64 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 37/66 (scale 3.2723678730092941e-06) ***** 
[1] xi(36)=0.999999999994 zeta(37)=0
Stats: nr=32 min=1 max=235 sum3=37722958
Emax=10.0034890541 nrkept=497 nrkeptmult=1152 
Total energy=-3.38377218622  Egs=-1.00893634897
Kept: 497 out of 1792, ratio=0.277
Memory used: 63 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 38/66 (scale 2.3139135135418709e-06) ***** 
[1] xi(37)=0.999999999997 zeta(38)=0
Stats: nr=32 min=1 max=234 sum3=42941092
Emax=10.0102243196 nrkept=467 nrkeptmult=1075 
Total energy=-3.383775288  Egs=-1.34049327526
Kept: 467 out of 1858, ratio=0.251
Memory used: 63 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 39/66 (scale 1.6361839365046471e-06) ***** 
[1] xi(38)=0.999999999998 zeta(39)=0
Stats: nr=32 min=1 max=229 sum3=35375141
Emax=10.0156197394 nrkept=486 nrkeptmult=1123 
Total energy=-3.38377693816  Egs=-1.00854042219
Kept: 486 out of 1745, ratio=0.279
Memory used: 63 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 40/66 (scale 1.1569567567709354e-06) ***** 
[1] xi(39)=0.999999999999 zeta(40)=0
Stats: nr=32 min=1 max=228 sum3=40347088
Emax=10.0464871461 nrkept=465 nrkeptmult=1069 
Total energy=-3.38377848885  Egs=-1.34031636814
Kept: 465 out of 1816, ratio=0.256
Memory used: 63 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 41/66 (scale 8.1809196825232353e-07) ***** 
[1] xi(40)=1 zeta(41)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.0431095412 nrkept=485 nrkeptmult=1118 
Total energy=-3.38377931376  Egs=-1.0083403305
Kept: 485 out of 1737, ratio=0.279
Memory used: 63 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 42/66 (scale 5.7847837838546772e-07) ***** 
[1] xi(41)=1 zeta(42)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0647874792 nrkept=465 nrkeptmult=1069 
Total energy=-3.38378008905  Egs=-1.34022590996
Kept: 465 out of 1812, ratio=0.257
Memory used: 63 MB  Time elapsed: 31 s

 ***** [NRG] Iteration 43/66 (scale 4.0904598412616176e-07) ***** 
[1] xi(42)=1 zeta(43)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.05709596 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378050147  Egs=-1.0082397382
Kept: 485 out of 1737, ratio=0.279
Memory used: 63 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 44/66 (scale 2.8923918919273386e-07) ***** 
[1] xi(43)=1 zeta(44)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0739758848 nrkept=465 nrkeptmult=1069 
Total energy=-3.3837808891  Egs=-1.34018016907
Kept: 465 out of 1812, ratio=0.257
Memory used: 63 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 45/66 (scale 2.0452299206308088e-07) ***** 
[1] xi(44)=1 zeta(45)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.0641495396 nrkept=485 nrkeptmult=1118 
Total energy=-3.3837810953  Egs=-1.00818930352
Kept: 485 out of 1737, ratio=0.279
Memory used: 63 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 46/66 (scale 1.4461959459636693e-07) ***** 
[1] xi(45)=1 zeta(46)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0785790768 nrkept=465 nrkeptmult=1069 
Total energy=-3.38378128911  Egs=-1.34015716935
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 47/66 (scale 1.0226149603154044e-07) ***** 
[1] xi(46)=1 zeta(47)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.0676914108 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378139221  Egs=-1.00816405128
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 48/66 (scale 7.2309797298183465e-08) ***** 
[1] xi(47)=1 zeta(48)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.080882848 nrkept=465 nrkeptmult=1069 
Total energy=-3.38378148912  Egs=-1.34014563703
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 49/66 (scale 5.113074801577022e-08) ***** 
[1] xi(48)=1 zeta(49)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.0694661148 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378154066  Egs=-1.00815141637
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 50/66 (scale 3.6154898649091733e-08) ***** 
[1] xi(49)=1 zeta(50)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0820352679 nrkept=465 nrkeptmult=1069 
Total energy=-3.38378158912  Egs=-1.34013986278
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 51/66 (scale 2.556537400788511e-08) ***** 
[1] xi(50)=1 zeta(51)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.0703544086 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378161489  Egs=-1.00814509668
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 32 s

 ***** [NRG] Iteration 52/66 (scale 1.8077449324545866e-08) ***** 
[1] xi(51)=1 zeta(52)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0826116102 nrkept=465 nrkeptmult=1069 
Total energy=-3.38378163912  Egs=-1.34013697367
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 53/66 (scale 1.2782687003942555e-08) ***** 
[1] xi(52)=1 zeta(53)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.070798791 nrkept=485 nrkeptmult=1118 
Total energy=-3.383781652  Egs=-1.00814193624
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 54/66 (scale 9.0387246622729332e-09) ***** 
[1] xi(53)=1 zeta(54)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0828998141 nrkept=465 nrkeptmult=1069 
Total energy=-3.38378166412  Egs=-1.34013552865
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 55/66 (scale 6.3913435019712775e-09) ***** 
[1] xi(54)=1 zeta(55)=0
Stats: nr=32 min=1 max=228 sum3=34952679
Emax=10.0710210413 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378167056  Egs=-1.00814035584
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 56/66 (scale 4.5193623311364666e-09) ***** 
[1] xi(55)=1 zeta(56)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0830253879 nrkept=465 nrkeptmult=1067 
Total energy=-3.38378167662  Egs=-1.34013480607
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 57/66 (scale 3.1956717509856388e-09) ***** 
[1] xi(56)=1 zeta(57)=0
Stats: nr=32 min=1 max=228 sum3=34991517
Emax=10.0711321813 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378167984  Egs=-1.00813956556
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 58/66 (scale 2.2596811655682333e-09) ***** 
[1] xi(57)=1 zeta(58)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0830685307 nrkept=465 nrkeptmult=1067 
Total energy=-3.38378168287  Egs=-1.34013444479
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 59/66 (scale 1.5978358754928194e-09) ***** 
[1] xi(58)=1 zeta(59)=0
Stats: nr=32 min=1 max=228 sum3=34991517
Emax=10.0711877551 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378168448  Egs=-1.00813917037
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 33 s

 ***** [NRG] Iteration 60/66 (scale 1.1298405827841166e-09) ***** 
[1] xi(59)=1 zeta(60)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0830903846 nrkept=465 nrkeptmult=1067 
Total energy=-3.38378168599  Egs=-1.3401342642
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 34 s

 ***** [NRG] Iteration 61/66 (scale 7.9891793774640969e-10) ***** 
[1] xi(60)=1 zeta(61)=0
Stats: nr=32 min=1 max=228 sum3=34991517
Emax=10.0712155432 nrkept=485 nrkeptmult=1118 
Total energy=-3.3837816868  Egs=-1.00813897272
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 34 s

 ***** [NRG] Iteration 62/66 (scale 5.6492029139205832e-10) ***** 
[1] xi(61)=1 zeta(62)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0831013067 nrkept=465 nrkeptmult=1067 
Total energy=-3.38378168755  Egs=-1.34013417396
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 34 s

 ***** [NRG] Iteration 63/66 (scale 3.9945896887320485e-10) ***** 
[1] xi(62)=1 zeta(63)=0
Stats: nr=32 min=1 max=228 sum3=34991517
Emax=10.0712294376 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378168796  Egs=-1.00813887386
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 34 s

 ***** [NRG] Iteration 64/66 (scale 2.8246014569602916e-10) ***** 
[1] xi(63)=1 zeta(64)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0831067663 nrkept=465 nrkeptmult=1067 
Total energy=-3.38378168833  Egs=-1.34013412888
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 34 s

 ***** [NRG] Iteration 65/66 (scale 1.9972948443660242e-10) ***** 
[1] xi(64)=1 zeta(65)=0
Stats: nr=32 min=1 max=228 sum3=34991517
Emax=10.0712363851 nrkept=485 nrkeptmult=1118 
Total energy=-3.38378168854  Egs=-1.00813882438
Kept: 485 out of 1737, ratio=0.279
Memory used: 64 MB  Time elapsed: 34 s

 ***** [NRG] Iteration 66/66 (scale 1.4123007284801458e-10) ***** 
[1] xi(65)=1 zeta(66)=0
Stats: nr=32 min=1 max=228 sum3=40307766
Emax=10.0831094955 nrkept=465 nrkeptmult=1067 
Total energy=-3.38378168873  Egs=-1.3401341064
Kept: 465 out of 1812, ratio=0.257
Memory used: 64 MB  Time elapsed: 34 s

** Iteration completed.


Total energy:             -3.383781688725097
TKW=6.97907652059e-05
Grand canonical Z=               9.91961847879713
Zft (last shell)=               9.900276721526735
Master done. Terminating slave processes.
Master exiting.

Memory usage report (process 0)
===================
  after diag: 114372 kB
after recalc: 66524 kB
 after split: 121424 kB
  after trim: 66524 kB
 after trunc: 114520 kB
      diag_h: 116780 kB

Peak usage: 121424 kB

Timing report (process 0)
=============
         All: 34 s
        diag: 33 s
       Other: 1 s
