NRG Ljubljana 2.4.3.31 - (c) Rok Zitko <rok.zitko@ijs.si>
Timestamp: Mon Nov 13 12:55:52 2017
Compiled on Aug 14 2018 at 10:37:37
Compiled-in symmetry types: ANYJ DBLISOSZ DBLSU2 ISO ISO2 ISO2LR ISOLR ISOSZ ISOSZLR NONE P PP QJ QS QSC3 QSLR QST QSTZ QSZ QSZLR QSZTZ SL SL3 SPSU2 SPSU2C3 SPSU2LR SPSU2T SPU1 SPU1LR SU2 U1 

No MPI: single node calculation.

[OMP] Max. number of threads: 1
[OMP] Number of processors: 32
[OMP] Dynamic thread adjustment: 0
[OMP] Nested parallelism: 0

Using Intel MKL library 11.3.2
Processor optimization: Intel(R) Advanced Vector Extensions 2 (Intel(R) AVX2) enabled processors
max_threads=1 blas_max_threads=1 dynamic=1

workdir=/work/zitko/nrg/work.4Dzn5yp5Mj
substeps=0
Ninit=0
Lambda=2
strategy=kept
lastall=0
lastalloverride=0
z=0.25
discretization=Z
band=flat
bandrescale=1
betabar=1
T=-999
keep=5000
keepenergy=10
keepmin=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
accumulation=0
linstep=0
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
dumpannotated=0
dumpscaled=1
dumpabs=0
dumpprecision=8
dumpgroups=1
grouptol=1e-06
dumpdiagonal=0
ops=
specs=
specd=
spect=
specq=
specot=
reim=0
specgt=
gtp=0.7
speci1t=
speci2t=
specchit=
chitp=1
chitp_ratio=-999
dm=0
T0opt=-1
dmnrg=0
cfs=0
cfsgt=0
cfsls=0
fdm=0
fdmgt=0
fdmls=0
fdmexpv=0
fdmexpvn=0
cfsold=0
fdmold=0
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
zheevrlimit=100
restart=1
restartfactor=2
checkdiag=0
checkrho=0
calc0=1
tdht=0
spin=2
tri=old
preccpp=2000
checksumrules=0
globalB=0
globalBx=0
polarized=0
pol2x2=0
mpi=0
noimag=1
dumpsubspaces=0
done=1
resume=0
forcestop=-1
stopafter=
removefiles=1
dump_f=0
rungs=0

>>  Input file for NRG Ljubljana, Rok Zitko, rok.zitko@ijs.si, 2005-2015
SYMMETRY TYPE: QS
invdim=2
0 Q additive
1 SS additive
I=(0 1) [0 (additive), 1 (additive)]
singlet QNs=(0 1) mult=1
>>  Using sneg version 	1.250
V8
>>  Number of channels, impurities, chain sites, subspaces: 
channels=1 impurities=0 Nmax=67 subspaces=4
Reading <||||> (e)
Reading <||||> (z)

length_coef_table=67 Nmax=67

Number of invariant subspaces: 4
(-1 2) 1 states
0.08742974690641159 
(0 1) 1 states
0 
(0 3) 1 states
0.1165729958752154 
(1 2) 1 states
0.08742974690641159 
Number of states (multiplicity taken into account): 8

Computing the following operators:
s=[]
p=[]
g=[]
d=[]
v=[]
t=[]
q=[]
ot=[]

Computing the following spectra:

Before NRG iteration (N=-1)

 ***** [NRG] Iteration 1/67 (scale 1.2131570881878404) ***** 
[1] xi(0)=0.5739838990129388 xi_scaled(0)=0.4731323788169347 zeta(1)=0
Stats: nr=8 min=1 max=4
Emax=1.897947880450077 nrkept=15 nrkeptmult=32 
Total energy=-1.151539536988605  Egs=-0.8255645923683794
Kept: 15 out of 15, ratio=1
Memory used: 46 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/67 (scale 0.85783160370214839) ***** 
[1] xi(1)=0.5417369026256507 xi_scaled(1)=0.6315189371523197 zeta(2)=0
Stats: nr=13 min=1 max=9
Emax=3.800471519140242 nrkept=56 nrkeptmult=128 
Total energy=-1.656730653065172  Egs=-0.5889164189058914
Kept: 56 out of 56, ratio=1
Memory used: 46 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/67 (scale 0.6065785440939202) ***** 
[1] xi(2)=0.5912860462544053 xi_scaled(2)=0.9747889238938411 zeta(3)=0
Stats: nr=19 min=1 max=35
Emax=8.487265542825519 nrkept=210 nrkeptmult=512 
Total energy=-2.574535897404569  Egs=-1.51308557362571
Kept: 210 out of 210, ratio=1
Memory used: 54 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/67 (scale 0.4289158018510742) ***** 
[1] xi(3)=0.5158729607424856 xi_scaled(3)=1.202737130495379 zeta(4)=0
Stats: nr=26 min=1 max=99
Safeguard: keep additional 1 states
Emax=10.30664757529786 nrkept=680 nrkeptmult=1772 
Total energy=-3.083252423030691  Egs=-1.186052188869358
Kept: 680 out of 792, ratio=0.859
Memory used: 67 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/67 (scale 0.3032892720469601) ***** 
[1] xi(4)=0.3404542429566779 xi_scaled(4)=1.122539681865052 zeta(5)=0
Stats: nr=34 min=1 max=305
Emax=10.23052727954397 nrkept=1046 nrkeptmult=2808 
Total energy=-3.553478323535809  Egs=-1.550420485800467
Kept: 1046 out of 2580, ratio=0.405
Memory used: 72 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/67 (scale 0.2144579009255371) ***** 
[1] xi(5)=0.2214135831146372 xi_scaled(5)=1.032433788445571 zeta(6)=0
Stats: nr=40 min=2 max=418
Safeguard: keep additional 1 states
Emax=10.00050911840954 nrkept=1102 nrkeptmult=2904 
Total energy=-3.756514720166419  Egs=-0.9467424410775465
Kept: 1102 out of 3966, ratio=0.278
Memory used: 79 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/67 (scale 0.15164463602348005) ***** 
[1] xi(6)=0.152902811956196 xi_scaled(6)=1.008296870668878 zeta(7)=0
Stats: nr=40 min=1 max=477
Safeguard: keep additional 2 states
Emax=10.00115465305018 nrkept=932 nrkeptmult=2438 
Total energy=-3.975563240106948  Egs=-1.444485777305125
Kept: 932 out of 4189, ratio=0.222
Memory used: 80 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/67 (scale 0.10722895046276855) ***** 
[1] xi(7)=0.1075508678417629 xi_scaled(7)=1.003002149863493 zeta(8)=0
Stats: nr=40 min=1 max=380
Safeguard: keep additional 3 states
Emax=10.00145411713209 nrkept=932 nrkeptmult=2372 
Total energy=-4.075704368471566  Egs=-0.933900107503045
Kept: 932 out of 3542, ratio=0.263
Memory used: 80 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/67 (scale 0.075822318011740025) ***** 
[1] xi(8)=0.07592236585864423 xi_scaled(8)=1.001319503934036 zeta(9)=0
Stats: nr=34 min=1 max=424
Emax=10.0008135683992 nrkept=797 nrkeptmult=2050 
Total energy=-4.183845644839428  Egs=-1.426245981441997
Kept: 797 out of 3529, ratio=0.226
Memory used: 80 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/67 (scale 0.053614475231384275) ***** 
[1] xi(9)=0.05364782713658343 xi_scaled(9)=1.000622069041154 zeta(10)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 1 states
Emax=10.01204069325913 nrkept=914 nrkeptmult=2324 
Total energy=-4.234392039473542  Egs=-0.9427751445103474
Kept: 914 out of 3020, ratio=0.303
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 11/67 (scale 0.037911159005870013) ***** 
[1] xi(10)=0.03792261705256315 xi_scaled(10)=1.000302234144078 zeta(11)=0
Stats: nr=34 min=1 max=416
Emax=10.00520391982393 nrkept=797 nrkeptmult=2050 
Total energy=-4.287857553486884  Egs=-1.410284344117862
Kept: 797 out of 3461, ratio=0.23
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 12/67 (scale 0.026807237615692137) ***** 
[1] xi(11)=0.02681123139335603 xi_scaled(11)=1.000148981320685 zeta(12)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 2 states
Emax=10.00365145004996 nrkept=898 nrkeptmult=2278 
Total energy=-4.313471814207446  Egs=-0.9554979549839357
Kept: 898 out of 3020, ratio=0.297
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 13/67 (scale 0.018955579502935006) ***** 
[1] xi(12)=0.01895698153749041 xi_scaled(12)=1.000073964214873 zeta(13)=0
Stats: nr=34 min=1 max=410
Emax=10.01141371345713 nrkept=797 nrkeptmult=2050 
Total energy=-4.339866976454404  Egs=-1.392474561005721
Kept: 797 out of 3397, ratio=0.235
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 14/67 (scale 0.013403618807846069) ***** 
[1] xi(13)=0.01340411275001429 xi_scaled(13)=1.000036851403737 zeta(14)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 1 states
Emax=10.01173163259745 nrkept=886 nrkeptmult=2244 
Total energy=-4.352882566559019  Egs=-0.9710504522104106
Kept: 886 out of 3020, ratio=0.293
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 15/67 (scale 0.0094777897514675032) ***** 
[1] xi(14)=0.009477964077759639 xi_scaled(14)=1.000018393137715 zeta(15)=0
Stats: nr=34 min=1 max=404
Emax=10.01939574905161 nrkept=797 nrkeptmult=2050 
Total energy=-4.365883376090862  Egs=-1.371713223521275
Kept: 797 out of 3349, ratio=0.238
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 16/67 (scale 0.0067018094039230343) ***** 
[1] xi(15)=0.006701870983107951 xi_scaled(15)=1.000009188441689 zeta(16)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 3 states
Emax=10.01057889340965 nrkept=878 nrkeptmult=2224 
Total energy=-4.372516806310049  Egs=-0.989796906982146
Kept: 878 out of 3020, ratio=0.291
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 17/67 (scale 0.0047388948757337516) ***** 
[1] xi(16)=0.004738916637643105 xi_scaled(16)=1.00000459219078 zeta(17)=0
Stats: nr=34 min=1 max=398
Safeguard: keep additional 3 states
Emax=10.023541880704 nrkept=800 nrkeptmult=2058 
Total energy=-4.378900670056676  Egs=-1.347120776895894
Kept: 800 out of 3317, ratio=0.241
Memory used: 80 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 18/67 (scale 0.0033509047019615172) ***** 
[1] xi(17)=0.003350912394258439 xi_scaled(17)=1.000002295588089 zeta(18)=0
Stats: nr=40 min=1 max=328
Safeguard: keep additional 3 states
Emax=10.00158094026509 nrkept=862 nrkeptmult=2172 
Total energy=-4.38229361495465  Egs=-1.012545924086539
Kept: 862 out of 3032, ratio=0.284
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 19/67 (scale 0.0023694474378668758) ***** 
[1] xi(18)=0.002369450157204092 xi_scaled(18)=1.000001147667246 zeta(19)=0
Stats: nr=34 min=1 max=390
Safeguard: keep additional 2 states
Emax=10.00163486778 nrkept=796 nrkeptmult=2046 
Total energy=-4.385415825963865  Egs=-1.317695830394206
Kept: 796 out of 3253, ratio=0.245
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 20/67 (scale 0.0016754523509807586) ***** 
[1] xi(19)=0.001675453312358546 xi_scaled(19)=1.000000573801927 zeta(20)=0
Stats: nr=40 min=1 max=326
Safeguard: keep additional 1 states
Emax=10.01250561233125 nrkept=848 nrkeptmult=2120 
Total energy=-4.387159033932842  Egs=-1.040440193931026
Kept: 848 out of 3016, ratio=0.281
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 21/67 (scale 0.0011847237189334379) ***** 
[1] xi(20)=0.001184724058822427 xi_scaled(20)=1.00000028689304 zeta(21)=0
Stats: nr=34 min=1 max=388
Safeguard: keep additional 3 states
Emax=10.00756840421337 nrkept=803 nrkeptmult=2062 
Total energy=-4.38867812519968  Egs=-1.28223250920155
Kept: 803 out of 3197, ratio=0.251
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 22/67 (scale 0.00083772617549037929) ***** 
[1] xi(21)=0.0008377262956576245 xi_scaled(21)=1.000000143444539 zeta(22)=0
Stats: nr=40 min=1 max=329
Emax=10.00720938868531 nrkept=836 nrkeptmult=2084 
Total energy=-4.389578660990624  Egs=-1.074976307641933
Kept: 836 out of 3040, ratio=0.275
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 23/67 (scale 0.00059236185946671895) ***** 
[1] xi(22)=0.0005923619019519626 xi_scaled(22)=1.000000071721774 zeta(23)=0
Stats: nr=34 min=1 max=386
Safeguard: keep additional 1 states
Emax=10.00936002702718 nrkept=802 nrkeptmult=2060 
Total energy=-4.39031280753449  Egs=-1.239354850641596
Kept: 802 out of 3152, ratio=0.254
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 24/67 (scale 0.00041886308774518965) ***** 
[1] xi(23)=0.0004188631027659398 xi_scaled(23)=1.000000035860763 zeta(24)=0
Stats: nr=40 min=1 max=330
Safeguard: keep additional 1 states
Emax=10.00161218386182 nrkept=821 nrkeptmult=2035 
Total energy=-4.390781092286482  Egs=-1.117990020350133
Kept: 821 out of 3034, ratio=0.271
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 25/67 (scale 0.00029618092973335947) ***** 
[1] xi(24)=0.0002961809350439874 xi_scaled(24)=1.000000017930351 zeta(25)=0
Stats: nr=34 min=1 max=381
Emax=10.00421060129349 nrkept=801 nrkeptmult=2056 
Total energy=-4.391132882767406  Egs=-1.187755340089317
Kept: 801 out of 3093, ratio=0.259
Memory used: 80 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 26/67 (scale 0.00020943154387259482) ***** 
[1] xi(25)=0.0002094315457501837 xi_scaled(25)=1.000000008965168 zeta(26)=0
Stats: nr=40 min=1 max=329
Safeguard: keep additional 1 states
Emax=10.00160849857733 nrkept=792 nrkeptmult=1972 
Total energy=-4.391378216416982  Egs=-1.171426448184438
Kept: 792 out of 3028, ratio=0.262
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 27/67 (scale 0.00014809046486667974) ***** 
[1] xi(26)=0.0001480904655305074 xi_scaled(26)=1.000000004482582 zeta(27)=0
Stats: nr=34 min=1 max=366
Safeguard: keep additional 1 states
Emax=10.00546684344219 nrkept=795 nrkeptmult=2028 
Total energy=-4.391545095426377  Egs=-1.126872074752444
Kept: 795 out of 2985, ratio=0.266
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 28/67 (scale 0.00010471577193629741) ***** 
[1] xi(27)=0.0001047157721709959 xi_scaled(27)=1.00000000224129 zeta(28)=0
Stats: nr=38 min=1 max=326
Safeguard: keep additional 1 states
Emax=10.00705083189827 nrkept=769 nrkeptmult=1935 
Total energy=-4.391674581708815  Egs=-1.236549948917168
Kept: 769 out of 3004, ratio=0.256
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 29/67 (scale 7.4045232433339868e-05) ***** 
[1] xi(28)=7.404523251631829e-05 xi_scaled(28)=1.000000001120645 zeta(29)=0
Stats: nr=34 min=1 max=353
Safeguard: keep additional 2 states
Emax=10.01249108309928 nrkept=797 nrkeptmult=2022 
Total energy=-4.391752942570357  Egs=-1.058283686428373
Kept: 797 out of 2902, ratio=0.275
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 30/67 (scale 5.2357885968148706e-05) ***** 
[1] xi(29)=5.235788599748601e-05 xi_scaled(29)=1.000000000560322 zeta(30)=0
Stats: nr=38 min=1 max=326
Safeguard: keep additional 1 states
Emax=10.01741553738865 nrkept=760 nrkeptmult=1922 
Total energy=-4.391821643586179  Egs=-1.312142661066173
Kept: 760 out of 3008, ratio=0.253
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 31/67 (scale 3.7022616216669934e-05) ***** 
[1] xi(30)=3.702261622704224e-05 xi_scaled(30)=1.000000000280161 zeta(31)=0
Stats: nr=34 min=1 max=348
Emax=10.00015877035374 nrkept=766 nrkeptmult=1920 
Total energy=-4.391858201903086  Egs=-0.9874590356621135
Kept: 766 out of 2872, ratio=0.267
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 32/67 (scale 2.6178942984074353e-05) ***** 
[1] xi(31)=2.617894298774152e-05 xi_scaled(31)=1.000000000140081 zeta(32)=0
Stats: nr=38 min=1 max=317
Safeguard: keep additional 3 states
Emax=10.01567618333114 nrkept=721 nrkeptmult=1795 
Total energy=-4.391894644097934  Egs=-1.392042255861566
Kept: 721 out of 2890, ratio=0.249
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 33/67 (scale 1.8511308108334967e-05) ***** 
[1] xi(32)=1.851130810963151e-05 xi_scaled(32)=1.00000000007004 zeta(33)=0
Stats: nr=33 min=1 max=332
Safeguard: keep additional 1 states
Emax=10.02758341916549 nrkept=728 nrkeptmult=1800 
Total energy=-4.391911739594493  Egs=-0.9235163965242055
Kept: 728 out of 2718, ratio=0.268
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 34/67 (scale 1.3089471492037176e-05) ***** 
[1] xi(33)=1.308947149249557e-05 xi_scaled(33)=1.00000000003502 zeta(34)=0
Stats: nr=36 min=1 max=304
Safeguard: keep additional 1 states
Emax=10.02589663086577 nrkept=658 nrkeptmult=1614 
Total energy=-4.391930917181898  Egs=-1.465115487406627
Kept: 658 out of 2744, ratio=0.24
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 35/67 (scale 9.2556540541674836e-06) ***** 
[1] xi(34)=9.255654054329551e-06 xi_scaled(34)=1.00000000001751 zeta(35)=0
Stats: nr=33 min=1 max=311
Safeguard: keep additional 2 states
Emax=10.00342697330829 nrkept=688 nrkeptmult=1688 
Total energy=-4.391939011157394  Egs=-0.8744898468623928
Kept: 688 out of 2481, ratio=0.277
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 36/67 (scale 6.5447357460185882e-06) ***** 
[1] xi(35)=6.544735746075888e-06 xi_scaled(35)=1.000000000008755 zeta(36)=0
Stats: nr=36 min=1 max=286
Safeguard: keep additional 1 states
Emax=10.01331700803253 nrkept=604 nrkeptmult=1452 
Total energy=-4.391948967222545  Egs=-1.521232565725859
Kept: 604 out of 2592, ratio=0.233
Memory used: 80 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 37/67 (scale 4.6278270270837418e-06) ***** 
[1] xi(36)=4.627827027104e-06 xi_scaled(36)=1.000000000004378 zeta(37)=0
Stats: nr=33 min=1 max=291
Safeguard: keep additional 1 states
Emax=10.00350070616889 nrkept=615 nrkeptmult=1480 
Total energy=-4.391952864968257  Egs=-0.8422410106505454
Kept: 615 out of 2270, ratio=0.271
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 38/67 (scale 3.2723678730092941e-06) ***** 
[1] xi(37)=3.272367873016457e-06 xi_scaled(37)=1.000000000002189 zeta(38)=0
Stats: nr=36 min=1 max=260
Safeguard: keep additional 2 states
Emax=10.00357355592022 nrkept=545 nrkeptmult=1291 
Total energy=-4.39195796303074  Egs=-1.557912399046044
Kept: 545 out of 2310, ratio=0.236
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 39/67 (scale 2.3139135135418709e-06) ***** 
[1] xi(38)=2.313913513544403e-06 xi_scaled(38)=1.000000000001094 zeta(39)=0
Stats: nr=33 min=1 max=266
Emax=10.07019988981246 nrkept=570 nrkeptmult=1334 
Total energy=-4.391959868112211  Egs=-0.8233157634614903
Kept: 570 out of 2045, ratio=0.279
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 40/67 (scale 1.6361839365046471e-06) ***** 
[1] xi(39)=1.636183936505542e-06 xi_scaled(39)=1.000000000000547 zeta(40)=0
Stats: nr=34 min=1 max=245
Safeguard: keep additional 1 states
Emax=10.00107179147691 nrkept=511 nrkeptmult=1185 
Total energy=-4.391962452052836  Egs=-1.579248253396427
Kept: 511 out of 2136, ratio=0.239
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 41/67 (scale 1.1569567567709354e-06) ***** 
[1] xi(40)=1.156956756771252e-06 xi_scaled(40)=1.000000000000274 zeta(41)=0
Stats: nr=33 min=1 max=251
Emax=10.34743065062645 nrkept=567 nrkeptmult=1322 
Total energy=-4.391963392639493  Egs=-0.812983416654402
Kept: 567 out of 1910, ratio=0.297
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 42/67 (scale 8.1809196825232353e-07) ***** 
[1] xi(41)=8.180919682524354e-07 xi_scaled(41)=1.000000000000137 zeta(42)=0
Stats: nr=34 min=1 max=244
Safeguard: keep additional 1 states
Emax=10.13856941212638 nrkept=499 nrkeptmult=1149 
Total energy=-4.391964694067915  Egs=-1.590809435491586
Kept: 499 out of 2124, ratio=0.235
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 43/67 (scale 5.7847837838546772e-07) ***** 
[1] xi(42)=5.784783783855073e-07 xi_scaled(42)=1.000000000000068 zeta(43)=0
Stats: nr=33 min=1 max=245
Emax=10.64157420848092 nrkept=567 nrkeptmult=1322 
Total energy=-4.391965161230646  Egs=-0.8075716361874299
Kept: 567 out of 1862, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 44/67 (scale 4.0904598412616176e-07) ***** 
[1] xi(43)=4.090459841261758e-07 xi_scaled(43)=1.000000000000034 zeta(44)=0
Stats: nr=34 min=1 max=244
Safeguard: keep additional 1 states
Emax=10.3650733440782 nrkept=499 nrkeptmult=1149 
Total energy=-4.391965814409372  Egs=-1.596834467301618
Kept: 499 out of 2124, ratio=0.235
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 45/67 (scale 2.8923918919273386e-07) ***** 
[1] xi(44)=2.892391891927388e-07 xi_scaled(44)=1.000000000000017 zeta(45)=0
Stats: nr=33 min=1 max=245
Emax=10.73948702728449 nrkept=567 nrkeptmult=1322 
Total energy=-4.391966047189115  Egs=-0.804800149977083
Kept: 567 out of 1862, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 46/67 (scale 2.0452299206308088e-07) ***** 
[1] xi(45)=2.045229920630826e-07 xi_scaled(45)=1.000000000000008 zeta(46)=0
Stats: nr=34 min=1 max=244
Safeguard: keep additional 1 states
Emax=10.49272020427983 nrkept=499 nrkeptmult=1149 
Total energy=-4.391966374407689  Egs=-1.599910948457485
Kept: 499 out of 2124, ratio=0.235
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 47/67 (scale 1.4461959459636693e-07) ***** 
[1] xi(46)=1.446195945963676e-07 xi_scaled(46)=1.000000000000004 zeta(47)=0
Stats: nr=33 min=1 max=245
Emax=10.79050621085297 nrkept=567 nrkeptmult=1322 
Total energy=-4.391966490594699  Egs=-0.8033974277022959
Kept: 567 out of 1862, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 48/67 (scale 1.0226149603154044e-07) ***** 
[1] xi(47)=1.022614960315407e-07 xi_scaled(47)=1.000000000000002 zeta(48)=0
Stats: nr=34 min=1 max=244
Emax=10.51149160010954 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966654362962  Egs=-1.601465551328586
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 49/67 (scale 7.2309797298183465e-08) ***** 
[1] xi(48)=7.230979729818354e-08 xi_scaled(48)=1.000000000000001 zeta(49)=0
Stats: nr=33 min=1 max=246
Emax=10.81624469377598 nrkept=567 nrkeptmult=1322 
Total energy=-4.39196671240544  Egs=-0.8026917451477249
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 50/67 (scale 5.113074801577022e-08) ***** 
[1] xi(49)=5.113074801577025e-08 xi_scaled(49)=1.000000000000001 zeta(50)=0
Stats: nr=34 min=1 max=244
Emax=10.51875765396564 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966794329527  Egs=-1.602246990615267
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 51/67 (scale 3.6154898649091733e-08) ***** 
[1] xi(50)=3.615489864909175e-08 xi_scaled(50)=1 zeta(51)=0
Stats: nr=33 min=1 max=246
Emax=10.82889333161323 nrkept=567 nrkeptmult=1322 
Total energy=-4.391966823337969  Egs=-0.8023378136507454
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 52/67 (scale 2.556537400788511e-08) ***** 
[1] xi(51)=2.556537400788511e-08 xi_scaled(51)=1 zeta(52)=0
Stats: nr=34 min=1 max=244
Emax=10.52240832583607 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966864310028  Egs=-1.602638750695817
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 53/67 (scale 1.8077449324545866e-08) ***** 
[1] xi(52)=1.807744932454587e-08 xi_scaled(52)=1 zeta(53)=0
Stats: nr=33 min=1 max=246
Emax=10.83345487335133 nrkept=567 nrkeptmult=1324 
Total energy=-4.391966878811045  Egs=-0.8021605741000697
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 54/67 (scale 1.2782687003942555e-08) ***** 
[1] xi(53)=1.278268700394256e-08 xi_scaled(53)=1 zeta(54)=0
Stats: nr=34 min=1 max=243
Emax=10.52424996528574 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966899299582  Egs=-1.602834891591231
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 55/67 (scale 9.0387246622729332e-09) ***** 
[1] xi(54)=9.038724662272933e-09 xi_scaled(54)=1 zeta(55)=0
Stats: nr=33 min=1 max=246
Emax=10.83555194360278 nrkept=567 nrkeptmult=1324 
Total energy=-4.391966906549289  Egs=-0.8020718857184019
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 56/67 (scale 6.3913435019712775e-09) ***** 
[1] xi(55)=6.391343501971278e-09 xi_scaled(55)=1 zeta(56)=0
Stats: nr=34 min=1 max=243
Emax=10.52516652975293 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966916794185  Egs=-1.602933027345602
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 57/67 (scale 4.5193623311364666e-09) ***** 
[1] xi(56)=4.519362331136467e-09 xi_scaled(56)=1 zeta(57)=0
Stats: nr=33 min=1 max=246
Emax=10.83659935438921 nrkept=567 nrkeptmult=1324 
Total energy=-4.391966920418837  Egs=-0.8020275243568821
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 58/67 (scale 3.1956717509856388e-09) ***** 
[1] xi(57)=3.195671750985639e-09 xi_scaled(57)=1 zeta(58)=0
Stats: nr=34 min=1 max=243
Emax=10.52562510701682 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966925541442  Egs=-1.602982111560705
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 59/67 (scale 2.2596811655682333e-09) ***** 
[1] xi(58)=2.259681165568233e-09 xi_scaled(58)=1 zeta(59)=0
Stats: nr=33 min=1 max=246
Emax=10.83712277115898 nrkept=567 nrkeptmult=1324 
Total energy=-4.391966927353718  Egs=-0.8020053393813629
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 60/67 (scale 1.5978358754928194e-09) ***** 
[1] xi(59)=1.597835875492819e-09 xi_scaled(59)=1 zeta(60)=0
Stats: nr=34 min=1 max=243
Emax=10.5258544694945 nrkept=498 nrkeptmult=1142 
Total energy=-4.39196692991506  Egs=-1.603006657753955
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 61/67 (scale 1.1298405827841166e-09) ***** 
[1] xi(60)=1.129840582784117e-09 xi_scaled(60)=1 zeta(61)=0
Stats: nr=33 min=1 max=246
Emax=10.83738440794462 nrkept=567 nrkeptmult=1324 
Total energy=-4.391966930821185  Egs=-0.8019942458197827
Kept: 567 out of 1857, ratio=0.305
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 62/67 (scale 7.9891793774640969e-10) ***** 
[1] xi(61)=7.989179377464097e-10 xi_scaled(61)=1 zeta(62)=0
Stats: nr=34 min=1 max=243
Emax=10.52596916919899 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966932101866  Egs=-1.603018931872055
Kept: 498 out of 2124, ratio=0.234
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 63/67 (scale 5.6492029139205832e-10) ***** 
[1] xi(62)=5.649202913920583e-10 xi_scaled(62)=1 zeta(63)=0
Stats: nr=33 min=1 max=246
Safeguard: keep additional 2 states
Emax=10.83752004023906 nrkept=569 nrkeptmult=1330 
Total energy=-4.391966932554926  Egs=-0.8019886987706085
Kept: 569 out of 1857, ratio=0.306
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 64/67 (scale 3.9945896887320485e-10) ***** 
[1] xi(63)=3.994589688732048e-10 xi_scaled(63)=1 zeta(64)=0
Stats: nr=34 min=1 max=244
Emax=10.52602652366641 nrkept=498 nrkeptmult=1142 
Total energy=-4.391966933195269  Egs=-1.603025069186445
Kept: 498 out of 2132, ratio=0.234
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 65/67 (scale 2.8246014569602916e-10) ***** 
[1] xi(64)=2.824601456960292e-10 xi_scaled(64)=1 zeta(65)=0
Stats: nr=33 min=1 max=246
Safeguard: keep additional 8 states
Emax=10.83759771055158 nrkept=575 nrkeptmult=1340 
Total energy=-4.391966933421798  Egs=-0.8019859251789582
Kept: 575 out of 1857, ratio=0.31
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 66/67 (scale 1.9972948443660242e-10) ***** 
[1] xi(65)=1.997294844366024e-10 xi_scaled(65)=1 zeta(66)=0
Stats: nr=34 min=1 max=248
Emax=10.52604077124232 nrkept=498 nrkeptmult=1142 
Total energy=-4.39196693374197  Egs=-1.603028137907454
Kept: 498 out of 2154, ratio=0.231
Memory used: 80 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 67/67 (scale 1.4123007284801458e-10) ***** 
[1] xi(66)=1.412300728480146e-10 xi_scaled(66)=1 zeta(67)=0
Stats: nr=33 min=1 max=246
Safeguard: keep additional 8 states
Emax=10.83761594918119 nrkept=575 nrkeptmult=1340 
Total energy=-4.391966933855234  Egs=-0.8019845383663426
Kept: 575 out of 1857, ratio=0.31
Memory used: 80 MB  Time elapsed: 5 s

** Iteration completed.


Total energy:             -4.391966933855234
TKW=1.105767222408785e-05

Memory usage report
===================
  after diag: 82848 kB
after recalc: 82848 kB
 after split: 82848 kB
  after trim: 82848 kB
 after trunc: 82848 kB
      diag_h: 82848 kB

Peak usage: 82848 kB

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