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=.
substeps=0
Ninit=0
Lambda=2
strategy=kept
lastall=0
lastalloverride=0
z=1
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=20
dumpscaled=1
dumpabs=0
dumpprecision=8
dumpgroups=0
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=66 subspaces=4
Reading <||||> (e)
Reading <||||> (z)

length_coef_table=66 Nmax=66

Number of invariant subspaces: 4
(-1 2) 1 states
0.1470387215202821 
(0 1) 1 states
0 
(0 3) 1 states
0.1960516286937095 
(1 2) 1 states
0.1470387215202821 
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 1/66 (scale 0.72134752044448169) ***** 
[1] xi(0)=0.5452874708426226 xi_scaled(0)=0.7559289460184545 zeta(1)=0
Stats: nr=8 min=1 max=4
Emax=3.033314181875486 nrkept=15 nrkeptmult=32 
Total energy=-1.094352759815703  Egs=-1.309150905840516
Kept: 15 out of 15, ratio=1
Memory used: 43 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 2/66 (scale 0.51006972329839473) ***** 
[1] xi(1)=0.4155094682917544 xi_scaled(1)=0.8146130799625568 zeta(2)=0
Stats: nr=13 min=1 max=9
Emax=5.540799429450456 nrkept=56 nrkeptmult=128 
Total energy=-1.434928402021808  Egs=-0.6677040934791297
Kept: 56 out of 56, ratio=1
Memory used: 43 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 3/66 (scale 0.36067376022224085) ***** 
[1] xi(2)=0.3218991776760922 xi_scaled(2)=0.8924940297229927 zeta(3)=0
Stats: nr=19 min=1 max=35
Safeguard: keep additional 1 states
Emax=10.03854867875642 nrkept=209 nrkeptmult=510 
Total energy=-1.92821069776285  Egs=-1.36766893005216
Kept: 209 out of 210, ratio=0.995
Memory used: 51 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 4/66 (scale 0.25503486164919736) ***** 
[1] xi(3)=0.2402694094581714 xi_scaled(3)=0.942104180991005 zeta(4)=0
Stats: nr=26 min=1 max=98
Safeguard: keep additional 1 states
Emax=10.00810443557119 nrkept=572 nrkeptmult=1476 
Total energy=-2.145167139009101  Egs=-0.8506932732383737
Kept: 572 out of 788, ratio=0.726
Memory used: 64 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 5/66 (scale 0.18033688011112042) ***** 
[1] xi(4)=0.1749149187687819 xi_scaled(4)=0.9699342622596243 zeta(5)=0
Stats: nr=34 min=1 max=260
Emax=10.02654776282873 nrkept=753 nrkeptmult=1946 
Total energy=-2.400664546748111  Egs=-1.416778462517352
Kept: 753 out of 2169, ratio=0.347
Memory used: 67 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 6/66 (scale 0.12751743082459868) ***** 
[1] xi(5)=0.1255632919492426 xi_scaled(5)=0.9846755156317096 zeta(6)=0
Stats: nr=40 min=1 max=307
Safeguard: keep additional 3 states
Emax=10.00405354262761 nrkept=918 nrkeptmult=2340 
Total energy=-2.516801445739555  Egs=-0.9107531279483774
Kept: 918 out of 2854, ratio=0.322
Memory used: 70 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 7/66 (scale 0.090168440055560212) ***** 
[1] xi(6)=0.08947082529362729 xi_scaled(6)=0.9922632047143872 zeta(7)=0
Stats: nr=34 min=1 max=416
Emax=10.00712510826338 nrkept=797 nrkeptmult=2050 
Total energy=-2.645027579649208  Egs=-1.422073331097246
Kept: 797 out of 3477, ratio=0.229
Memory used: 74 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 8/66 (scale 0.063758715412299341) ***** 
[1] xi(7)=0.06351086930807648 xi_scaled(7)=0.9961127494081373 zeta(8)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 1 states
Emax=10.0095516685885 nrkept=914 nrkeptmult=2324 
Total energy=-2.704632365378997  Egs=-0.9348492256211826
Kept: 914 out of 3020, ratio=0.303
Memory used: 74 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 9/66 (scale 0.045084220027780106) ***** 
[1] xi(8)=0.04499637947017967 xi_scaled(8)=0.9980516340851342 zeta(9)=0
Stats: nr=34 min=1 max=416
Emax=10.00575818170924 nrkept=797 nrkeptmult=2050 
Total energy=-2.768299253317213  Egs=-1.412176763820811
Kept: 797 out of 3461, ratio=0.23
Memory used: 74 MB  Time elapsed: 0 s

 ***** [NRG] Iteration 10/66 (scale 0.031879357706149671) ***** 
[1] xi(9)=0.03184826348698654 xi_scaled(9)=0.9990246284304175 zeta(10)=0
Stats: nr=40 min=1 max=327
Emax=10.0007592714921 nrkept=899 nrkeptmult=2281 
Total energy=-2.798613975977387  Egs=-0.9509201201480355
Kept: 899 out of 3020, ratio=0.298
Memory used: 74 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 11/66 (scale 0.022542110013890053) ***** 
[1] xi(10)=0.02253110983902919 xi_scaled(10)=0.9995120166278095 zeta(11)=0
Stats: nr=34 min=1 max=411
Emax=10.0102257703852 nrkept=797 nrkeptmult=2050 
Total energy=-2.830091642898589  Egs=-1.396393988930326
Kept: 797 out of 3401, ratio=0.234
Memory used: 74 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** 
[1] xi(11)=0.01593578851722613 xi_scaled(11)=0.9997559338626226 zeta(12)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 1 states
Emax=10.00690506793517 nrkept=886 nrkeptmult=2244 
Total energy=-2.845502165423418  Egs=-0.9668025728044085
Kept: 886 out of 3020, ratio=0.293
Memory used: 74 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 13/66 (scale 0.011271055006945026) ***** 
[1] xi(12)=0.01126967935565226 xi_scaled(12)=0.9998779483116782 zeta(13)=0
Stats: nr=34 min=1 max=404
Emax=10.01746697478657 nrkept=797 nrkeptmult=2050 
Total energy=-2.861019854172855  Egs=-1.376773402301307
Kept: 797 out of 3349, ratio=0.238
Memory used: 74 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** 
[1] xi(13)=0.007969353023252924 xi_scaled(13)=0.9999389695000788 zeta(14)=0
Stats: nr=40 min=1 max=327
Safeguard: keep additional 3 states
Emax=10.00489611208633 nrkept=878 nrkeptmult=2224 
Total energy=-2.868870055785488  Egs=-0.984988679507667
Kept: 878 out of 3020, ratio=0.291
Memory used: 74 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** 
[1] xi(14)=0.005635355527382068 xi_scaled(14)=0.9999694835859927 zeta(15)=0
Stats: nr=34 min=1 max=398
Safeguard: keep additional 3 states
Emax=10.02451841293045 nrkept=800 nrkeptmult=2058 
Total energy=-2.876496373475458  Egs=-1.353257114843437
Kept: 800 out of 3317, ratio=0.241
Memory used: 74 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 16/66 (scale 0.0039849197132687088) ***** 
[1] xi(15)=0.00398485890937912 xi_scaled(15)=0.9999847415019714 zeta(16)=0
Stats: nr=40 min=1 max=328
Safeguard: keep additional 1 states
Emax=10.00616568743243 nrkept=864 nrkeptmult=2176 
Total energy=-2.880508270090956  Egs=-1.006769747992517
Kept: 864 out of 3032, ratio=0.285
Memory used: 74 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 17/66 (scale 0.0028177637517362566) ***** 
[1] xi(16)=0.002817742254109917 xi_scaled(16)=0.9999923706782278 zeta(17)=0
Stats: nr=34 min=1 max=392
Safeguard: keep additional 3 states
Emax=10.01264838711498 nrkept=800 nrkeptmult=2058 
Total energy=-2.884242063113492  Egs=-1.325090870458846
Kept: 800 out of 3261, ratio=0.245
Memory used: 74 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 18/66 (scale 0.0019924598566343544) ***** 
[1] xi(17)=0.00199245225603943 xi_scaled(17)=0.9999961853209243 zeta(18)=0
Stats: nr=40 min=1 max=328
Safeguard: keep additional 3 states
Emax=10.01964835417433 nrkept=852 nrkeptmult=2136 
Total energy=-2.8863009724411  Egs=-1.03335046914644
Kept: 852 out of 3032, ratio=0.281
Memory used: 74 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 19/66 (scale 0.0014088818758681283) ***** 
[1] xi(18)=0.001408879188645615 xi_scaled(18)=0.9999980926559147 zeta(19)=0
Stats: nr=34 min=1 max=388
Safeguard: keep additional 1 states
Emax=10.00295548564934 nrkept=799 nrkeptmult=2058 
Total energy=-2.888120079128895  Egs=-1.291170479905577
Kept: 799 out of 3213, ratio=0.249
Memory used: 74 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 20/66 (scale 0.0009962299283171772) ***** 
[1] xi(19)=0.000996228978239414 xi_scaled(19)=0.9999990463268206 zeta(20)=0
Stats: nr=40 min=1 max=329
Safeguard: keep additional 1 states
Emax=10.00467166621231 nrkept=838 nrkeptmult=2092 
Total energy=-2.889182236801124  Egs=-1.066177236838201
Kept: 838 out of 3028, ratio=0.277
Memory used: 74 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 21/66 (scale 0.00070444093793406415) ***** 
[1] xi(20)=0.0007044406020306494 xi_scaled(20)=0.999999523163126 zeta(21)=0
Stats: nr=34 min=1 max=386
Safeguard: keep additional 4 states
Emax=10.00546204222641 nrkept=805 nrkeptmult=2064 
Total energy=-2.890062902065506  Egs=-1.250161961008081
Kept: 805 out of 3160, ratio=0.255
Memory used: 74 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 22/66 (scale 0.0004981149641585886) ***** 
[1] xi(21)=0.000498114845398762 xi_scaled(21)=0.9999997615814918 zeta(22)=0
Stats: nr=40 min=1 max=329
Safeguard: keep additional 1 states
Emax=10.00159191980043 nrkept=823 nrkeptmult=2043 
Total energy=-2.890614327029589  Egs=-1.107023486062494
Kept: 823 out of 3046, ratio=0.27
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 23/66 (scale 0.00035222046896703208) ***** 
[1] xi(22)=0.0003522204269790865 xi_scaled(22)=0.9999998807907282 zeta(23)=0
Stats: nr=34 min=1 max=381
Safeguard: keep additional 2 states
Emax=10.00209038249046 nrkept=803 nrkeptmult=2060 
Total energy=-2.891037240103739  Egs=-1.200705556353785
Kept: 803 out of 3101, ratio=0.259
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 24/66 (scale 0.0002490574820792943) ***** 
[1] xi(23)=0.0002490574672343127 xi_scaled(23)=0.9999999403953597 zeta(24)=0
Stats: nr=40 min=1 max=329
Safeguard: keep additional 4 states
Emax=10.00338455102832 nrkept=798 nrkeptmult=1988 
Total energy=-2.891325612184446  Egs=-1.157853513571588
Kept: 798 out of 3036, ratio=0.263
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 25/66 (scale 0.00017611023448351604) ***** 
[1] xi(24)=0.0001761102292350223 xi_scaled(24)=0.9999999701976788 zeta(25)=0
Stats: nr=34 min=1 max=368
Safeguard: keep additional 1 states
Emax=10.00510034635794 nrkept=799 nrkeptmult=2048 
Total energy=-2.8915267246658  Egs=-1.141969300891735
Kept: 799 out of 3008, ratio=0.266
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 26/66 (scale 0.00012452874103964715) ***** 
[1] xi(25)=0.0001245287391840243 xi_scaled(25)=0.9999999850988391 zeta(26)=0
Stats: nr=40 min=1 max=328
Safeguard: keep additional 3 states
Emax=10.0156262991992 nrkept=774 nrkeptmult=1944 
Total energy=-2.891678675957917  Egs=-1.220210618436917
Kept: 774 out of 3020, ratio=0.256
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 27/66 (scale 8.8055117241758019e-05) ***** 
[1] xi(26)=8.805511658569628e-05 xi_scaled(26)=0.9999999925494195 zeta(27)=0
Stats: nr=34 min=1 max=356
Safeguard: keep additional 2 states
Emax=10.00449036789312 nrkept=797 nrkeptmult=2022 
Total energy=-2.891773323376118  Egs=-1.074865620150085
Kept: 797 out of 2921, ratio=0.273
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 28/66 (scale 6.2264370519823575e-05) ***** 
[1] xi(27)=6.226437028787072e-05 xi_scaled(27)=0.9999999962747097 zeta(28)=0
Stats: nr=38 min=1 max=326
Safeguard: keep additional 2 states
Emax=10.03565588411125 nrkept=763 nrkeptmult=1925 
Total energy=-2.891853873599988  Egs=-1.293680851459658
Kept: 763 out of 3008, ratio=0.254
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 29/66 (scale 4.402755862087901e-05) ***** 
[1] xi(28)=4.402755853887129e-05 xi_scaled(28)=0.9999999981373549 zeta(29)=0
Stats: nr=34 min=1 max=349
Safeguard: keep additional 1 states
Emax=10.00124031491376 nrkept=770 nrkeptmult=1932 
Total energy=-2.891898070154363  Egs=-1.003838408459706
Kept: 770 out of 2881, ratio=0.267
Memory used: 74 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 30/66 (scale 3.1132185259911788e-05) ***** 
[1] xi(29)=3.113218523091768e-05 xi_scaled(29)=0.9999999990686774 zeta(30)=0
Stats: nr=38 min=1 max=321
Safeguard: keep additional 1 states
Emax=10.00126959807665 nrkept=725 nrkeptmult=1811 
Total energy=-2.891940828243706  Egs=-1.373436814227825
Kept: 725 out of 2906, ratio=0.249
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 31/66 (scale 2.2013779310439505e-05) ***** 
[1] xi(30)=2.201377930018854e-05 xi_scaled(30)=0.9999999995343387 zeta(31)=0
Stats: nr=33 min=1 max=334
Safeguard: keep additional 1 states
Emax=10.00278087187299 nrkept=731 nrkeptmult=1818 
Total energy=-2.891961464129757  Egs=-0.9374076917660759
Kept: 731 out of 2734, ratio=0.267
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 32/66 (scale 1.5566092629955894e-05) ***** 
[1] xi(31)=1.556609262633163e-05 xi_scaled(31)=0.9999999997671692 zeta(32)=0
Stats: nr=36 min=1 max=304
Emax=10.00600219074361 nrkept=664 nrkeptmult=1634 
Total energy=-2.891984022563902  Egs=-1.449203385926994
Kept: 664 out of 2756, ratio=0.241
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 33/66 (scale 1.1006889655219752e-05) ***** 
[1] xi(32)=1.100688965393838e-05 xi_scaled(32)=0.9999999998835847 zeta(33)=0
Stats: nr=33 min=1 max=314
Emax=10.01664661198716 nrkept=699 nrkeptmult=1716 
Total energy=-2.891993757584382  Egs=-0.8844479035321836
Kept: 699 out of 2505, ratio=0.279
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 34/66 (scale 7.7830463149779469e-06) ***** 
[1] xi(33)=7.783046314524915e-06 xi_scaled(33)=0.9999999999417925 zeta(34)=0
Stats: nr=36 min=1 max=290
Safeguard: keep additional 3 states
Emax=10.04853575163974 nrkept=617 nrkeptmult=1485 
Total energy=-2.892005508849981  Egs=-1.50985425542018
Kept: 617 out of 2632, ratio=0.234
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 35/66 (scale 5.5034448276098762e-06) ***** 
[1] xi(34)=5.503444827449705e-06 xi_scaled(34)=0.9999999999708962 zeta(35)=0
Stats: nr=33 min=1 max=298
Emax=10.00372126655898 nrkept=627 nrkeptmult=1524 
Total energy=-2.892010178190787  Egs=-0.8484396506739399
Kept: 627 out of 2322, ratio=0.27
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 36/66 (scale 3.8915231574889735e-06) ***** 
[1] xi(35)=3.891523157432344e-06 xi_scaled(35)=0.9999999999854481 zeta(36)=0
Stats: nr=36 min=1 max=263
Safeguard: keep additional 3 states
Emax=10.00052323965986 nrkept=560 nrkeptmult=1330 
Total energy=-2.892016213508723  Egs=-1.55088835177255
Kept: 560 out of 2358, ratio=0.237
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 37/66 (scale 2.7517224138049381e-06) ***** 
[1] xi(36)=2.751722413784917e-06 xi_scaled(36)=0.999999999992724 zeta(37)=0
Stats: nr=33 min=1 max=272
Emax=10.00476949009588 nrkept=571 nrkeptmult=1338 
Total energy=-2.892018488691988  Egs=-0.8268215041010627
Kept: 571 out of 2101, ratio=0.272
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 38/66 (scale 1.9457615787444867e-06) ***** 
[1] xi(37)=1.945761578737408e-06 xi_scaled(37)=0.999999999996362 zeta(38)=0
Stats: nr=34 min=1 max=245
Emax=10.03893975922943 nrkept=518 nrkeptmult=1212 
Total energy=-2.892021553870106  Egs=-1.575310228757623
Kept: 518 out of 2140, ratio=0.242
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 39/66 (scale 1.3758612069024691e-06) ***** 
[1] xi(38)=1.375861206899966e-06 xi_scaled(38)=0.9999999999981811 zeta(39)=0
Stats: nr=33 min=1 max=254
Emax=10.23810979862714 nrkept=567 nrkeptmult=1322 
Total energy=-2.892022674998823  Egs=-0.8148559694494745
Kept: 567 out of 1938, ratio=0.293
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 40/66 (scale 9.7288078937224336e-07) ***** 
[1] xi(39)=9.728807893713586e-07 xi_scaled(39)=0.9999999999990906 zeta(40)=0
Stats: nr=34 min=1 max=244
Safeguard: keep additional 1 states
Emax=10.06841058765059 nrkept=499 nrkeptmult=1149 
Total energy=-2.892024220633573  Egs=-1.588719570728374
Kept: 499 out of 2124, ratio=0.235
Memory used: 74 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 41/66 (scale 6.8793060345123453e-07) ***** 
[1] xi(40)=6.879306034509217e-07 xi_scaled(40)=0.9999999999995453 zeta(41)=0
Stats: nr=33 min=1 max=245
Emax=10.60837802279973 nrkept=567 nrkeptmult=1322 
Total energy=-2.892024776853432  Egs=-0.8085406517428619
Kept: 567 out of 1862, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 42/66 (scale 4.8644039468612168e-07) ***** 
[1] xi(41)=4.86440394686011e-07 xi_scaled(41)=0.9999999999997725 zeta(42)=0
Stats: nr=34 min=1 max=244
Safeguard: keep additional 1 states
Emax=10.32204490499831 nrkept=499 nrkeptmult=1149 
Total energy=-2.892025553094255  Egs=-1.595757324977854
Kept: 499 out of 2124, ratio=0.235
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 43/66 (scale 3.4396530172561726e-07) ***** 
[1] xi(42)=3.439653017255781e-07 xi_scaled(42)=0.9999999999998863 zeta(43)=0
Stats: nr=33 min=1 max=245
Emax=10.72176632660566 nrkept=567 nrkeptmult=1322 
Total energy=-2.892025830087189  Egs=-0.8052932441628098
Kept: 567 out of 1862, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 44/66 (scale 2.4322019734306084e-07) ***** 
[1] xi(43)=2.43220197343047e-07 xi_scaled(43)=0.9999999999999432 zeta(44)=0
Stats: nr=34 min=1 max=244
Safeguard: keep additional 1 states
Emax=10.4696994640012 nrkept=499 nrkeptmult=1149 
Total energy=-2.892026219084831  Egs=-1.599364061649435
Kept: 499 out of 2124, ratio=0.235
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 45/66 (scale 1.7198265086280863e-07) ***** 
[1] xi(44)=1.719826508628037e-07 xi_scaled(44)=0.9999999999999716 zeta(45)=0
Stats: nr=33 min=1 max=245
Emax=10.7814004705937 nrkept=567 nrkeptmult=1322 
Total energy=-2.892026357298031  Egs=-0.8036461754029762
Kept: 567 out of 1862, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 46/66 (scale 1.2161009867153042e-07) ***** 
[1] xi(45)=1.216100986715287e-07 xi_scaled(45)=0.9999999999999859 zeta(46)=0
Stats: nr=34 min=1 max=244
Emax=10.50893472143888 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026552018904  Egs=-1.601189995239095
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 47/66 (scale 8.5991325431404316e-08) ***** 
[1] xi(46)=8.599132543140371e-08 xi_scaled(46)=0.9999999999999929 zeta(47)=0
Stats: nr=33 min=1 max=246
Emax=10.81167800849665 nrkept=567 nrkeptmult=1322 
Total energy=-2.892026621054174  Egs=-0.8028166761677863
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 48/66 (scale 6.080504933576521e-08) ***** 
[1] xi(47)=6.0805049335765e-08 xi_scaled(47)=0.9999999999999966 zeta(48)=0
Stats: nr=34 min=1 max=244
Emax=10.51746992797993 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026718470471  Egs=-1.602108680121784
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 49/66 (scale 4.2995662715702158e-08) ***** 
[1] xi(48)=4.299566271570209e-08 xi_scaled(48)=0.9999999999999983 zeta(49)=0
Stats: nr=33 min=1 max=246
Emax=10.82673375140825 nrkept=567 nrkeptmult=1322 
Total energy=-2.892026752970209  Egs=-0.8024004193473473
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 50/66 (scale 3.0402524667882605e-08) ***** 
[1] xi(49)=3.040252466788258e-08 xi_scaled(49)=0.9999999999999991 zeta(50)=0
Stats: nr=34 min=1 max=244
Emax=10.52176233572022 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026801692366  Egs=-1.602569461799406
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 51/66 (scale 2.1497831357851079e-08) ***** 
[1] xi(50)=2.149783135785107e-08 xi_scaled(50)=0.9999999999999996 zeta(51)=0
Stats: nr=33 min=1 max=246
Emax=10.83271282188803 nrkept=567 nrkeptmult=1324 
Total energy=-2.892026818937753  Egs=-0.8021919121075411
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 52/66 (scale 1.5201262333941303e-08) ***** 
[1] xi(51)=1.52012623339413e-08 xi_scaled(51)=0.9999999999999998 zeta(52)=0
Stats: nr=34 min=1 max=243
Emax=10.52392617252751 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026843302339  Egs=-1.602800213663433
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 53/66 (scale 1.0748915678925539e-08) ***** 
[1] xi(52)=1.074891567892554e-08 xi_scaled(52)=0.9999999999999999 zeta(53)=0
Stats: nr=33 min=1 max=246
Emax=10.83518152647561 nrkept=567 nrkeptmult=1324 
Total energy=-2.892026851923911  Egs=-0.8020875635258864
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 54/66 (scale 7.6006311669706513e-09) ***** 
[1] xi(53)=7.600631166970651e-09 xi_scaled(53)=1 zeta(54)=0
Stats: nr=34 min=1 max=243
Emax=10.52500448212774 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026864107081  Egs=-1.602915680003515
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 55/66 (scale 5.3744578394627697e-09) ***** 
[1] xi(54)=5.37445783946277e-09 xi_scaled(54)=1 zeta(55)=0
Stats: nr=33 min=1 max=246
Emax=10.83641429480123 nrkept=567 nrkeptmult=1324 
Total energy=-2.892026868417587  Egs=-0.8020353654632209
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 56/66 (scale 3.8003155834853256e-09) ***** 
[1] xi(55)=3.800315583485326e-09 xi_scaled(55)=1 zeta(56)=0
Stats: nr=34 min=1 max=243
Emax=10.52554404533721 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026874509392  Egs=-1.602973435794122
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 57/66 (scale 2.6872289197313849e-09) ***** 
[1] xi(56)=2.687228919731385e-09 xi_scaled(56)=1 zeta(57)=0
Stats: nr=33 min=1 max=246
Emax=10.83703027820494 nrkept=567 nrkeptmult=1324 
Total energy=-2.892026876664574  Egs=-0.8020092604853386
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 58/66 (scale 1.9001577917426628e-09) ***** 
[1] xi(57)=1.900157791742663e-09 xi_scaled(57)=1 zeta(58)=0
Stats: nr=34 min=1 max=243
Emax=10.52581392918312 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026879710532  Egs=-1.603002319346685
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 59/66 (scale 1.3436144598656924e-09) ***** 
[1] xi(58)=1.343614459865692e-09 xi_scaled(58)=1 zeta(59)=0
Stats: nr=33 min=1 max=246
Emax=10.83733817062831 nrkept=567 nrkeptmult=1324 
Total energy=-2.892026880788105  Egs=-0.8019962065094778
Kept: 567 out of 1857, ratio=0.305
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 60/66 (scale 9.5007889587133141e-10) ***** 
[1] xi(59)=9.500788958713314e-10 xi_scaled(59)=1 zeta(60)=0
Stats: nr=34 min=1 max=243
Emax=10.52594889667542 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026882311098  Egs=-1.603016762537434
Kept: 498 out of 2124, ratio=0.234
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 61/66 (scale 6.7180722993284622e-10) ***** 
[1] xi(60)=6.718072299328462e-10 xi_scaled(60)=1 zeta(61)=0
Stats: nr=33 min=1 max=246
Safeguard: keep additional 2 states
Emax=10.83749982425803 nrkept=569 nrkeptmult=1330 
Total energy=-2.89202688284988  Egs=-0.8019896791498687
Kept: 569 out of 1857, ratio=0.306
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 62/66 (scale 4.750394479356657e-10) ***** 
[1] xi(61)=4.750394479356657e-10 xi_scaled(61)=1 zeta(62)=0
Stats: nr=34 min=1 max=244
Emax=10.52601638681295 nrkept=498 nrkeptmult=1142 
Total energy=-2.89202688361138  Egs=-1.60302398448638
Kept: 498 out of 2132, ratio=0.234
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 63/66 (scale 3.3590361496642311e-10) ***** 
[1] xi(62)=3.359036149664231e-10 xi_scaled(62)=1 zeta(63)=0
Stats: nr=33 min=1 max=246
Safeguard: keep additional 5 states
Emax=10.83758121505976 nrkept=572 nrkeptmult=1334 
Total energy=-2.89202688388077  Egs=-0.8019864153771867
Kept: 572 out of 1857, ratio=0.308
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 64/66 (scale 2.3751972396783285e-10) ***** 
[1] xi(63)=2.375197239678329e-10 xi_scaled(63)=1 zeta(64)=0
Stats: nr=34 min=1 max=246
Emax=10.52603570234681 nrkept=498 nrkeptmult=1142 
Total energy=-2.89202688426152  Egs=-1.603027595549242
Kept: 498 out of 2142, ratio=0.232
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 65/66 (scale 1.6795180748321155e-10) ***** 
[1] xi(64)=1.679518074832116e-10 xi_scaled(64)=1 zeta(65)=0
Stats: nr=33 min=1 max=246
Safeguard: keep additional 8 states
Emax=10.83761278701808 nrkept=575 nrkeptmult=1340 
Total energy=-2.892026884396215  Egs=-0.8019847834676173
Kept: 575 out of 1857, ratio=0.31
Memory used: 74 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 66/66 (scale 1.1875986198391643e-10) ***** 
[1] xi(65)=1.187598619839164e-10 xi_scaled(65)=1 zeta(66)=0
Stats: nr=34 min=1 max=248
Emax=10.52605257674354 nrkept=498 nrkeptmult=1142 
Total energy=-2.892026884586591  Egs=-1.603029401102764
Kept: 498 out of 2154, ratio=0.231
Memory used: 74 MB  Time elapsed: 6 s

** Iteration completed.


Total energy:             -2.892026884586591
TKW=1.101559666115562e-05

Memory usage report
===================
  after diag: 76656 kB
after recalc: 76656 kB
 after split: 76656 kB
  after trim: 76656 kB
 after trunc: 76656 kB
      diag_h: 76656 kB

Peak usage: 76656 kB

Timing report
=============
         All: 6 s
        diag: 6 s
    recalc f: 0 s
       Other: 0 s
