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=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=1 Nmax=66 subspaces=6
Reading <||||> (e)
Reading <||||> (z)

length_coef_table=66 Nmax=66

Number of invariant subspaces: 6
(-2 1) 1 states
0.04390971719410867 
(-1 2) 2 states
0.02062117591551605 0.06229696775535856 
(0 1) 3 states
0 0.04390971719410867 0.08291814367087462 
(0 3) 1 states
0.03900842647676593 
(1 2) 2 states
0.02062117591551605 0.06229696775535856 
(2 1) 1 states
0.04390971719410867 
Number of states (multiplicity taken into account): 16

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=10 min=1 max=8
Emax=3.032891751092634 nrkept=35 nrkeptmult=64 
Total energy=-1.091384472213597  Egs=-1.457813893873241
Kept: 35 out of 35, 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=15 min=1 max=20
Emax=5.478567782706708 nrkept=126 nrkeptmult=256 
Total energy=-1.394725776498355  Egs=-0.5947055675510098
Kept: 126 out of 126, 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=21 min=1 max=75
Emax=10.00443184391298 nrkept=456 nrkeptmult=1014 
Total energy=-1.924357941350657  Egs=-1.468452167204934
Kept: 456 out of 462, ratio=0.987
Memory used: 59 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=28 min=1 max=206
Safeguard: keep additional 2 states
Emax=10.89507654032525 nrkept=1261 nrkeptmult=3043 
Total energy=-2.125664163993974  Egs=-0.7893282563080154
Kept: 1261 out of 1694, ratio=0.744
Memory used: 62 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=36 min=1 max=561
Safeguard: keep additional 2 states
Emax=10.00890056397017 nrkept=1685 nrkeptmult=4170 
Total energy=-2.396469123828279  Egs=-1.501661555126381
Kept: 1685 out of 4734, ratio=0.356
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=42 min=1 max=647
Safeguard: keep additional 2 states
Emax=10.86045891202096 nrkept=2123 nrkeptmult=5283 
Total energy=-2.506011611643668  Egs=-0.859039325894713
Kept: 2123 out of 6338, ratio=0.335
Memory used: 90 MB  Time elapsed: 1 s

 ***** [NRG] Iteration 7/66 (scale 0.090168440055560212) ***** 
[1] xi(6)=0.08947082529362729 xi_scaled(6)=0.9922632047143872 zeta(7)=0
Stats: nr=44 min=1 max=909
Safeguard: keep additional 3 states
Emax=10.03401313148133 nrkept=1786 nrkeptmult=4412 
Total energy=-2.640728364903082  Egs=-1.494056603135248
Kept: 1786 out of 8006, ratio=0.223
Memory used: 78 MB  Time elapsed: 2 s

 ***** [NRG] Iteration 8/66 (scale 0.063758715412299341) ***** 
[1] xi(7)=0.06351086930807648 xi_scaled(7)=0.9961127494081373 zeta(8)=0
Stats: nr=42 min=1 max=693
Safeguard: keep additional 1 states
Emax=10.00453814324082 nrkept=1970 nrkeptmult=4888 
Total energy=-2.697675979555924  Egs=-0.893173808232915
Kept: 1970 out of 6722, ratio=0.293
Memory used: 78 MB  Time elapsed: 3 s

 ***** [NRG] Iteration 9/66 (scale 0.045084220027780106) ***** 
[1] xi(8)=0.04499637947017967 xi_scaled(8)=0.9980516340851342 zeta(9)=0
Stats: nr=44 min=1 max=850
Safeguard: keep additional 1 states
Emax=10.00224405588105 nrkept=1660 nrkeptmult=4126 
Total energy=-2.764009956018192  Egs=-1.47133468032483
Kept: 1660 out of 7433, ratio=0.223
Memory used: 89 MB  Time elapsed: 4 s

 ***** [NRG] Iteration 10/66 (scale 0.031879357706149671) ***** 
[1] xi(9)=0.03184826348698654 xi_scaled(9)=0.9990246284304175 zeta(10)=0
Stats: nr=42 min=1 max=649
Emax=10.07530272537365 nrkept=1873 nrkeptmult=4641 
Total energy=-2.793288160113097  Egs=-0.918406335685279
Kept: 1873 out of 6268, ratio=0.299
Memory used: 78 MB  Time elapsed: 5 s

 ***** [NRG] Iteration 11/66 (scale 0.022542110013890053) ***** 
[1] xi(10)=0.02253110983902919 xi_scaled(10)=0.9995120166278095 zeta(11)=0
Stats: nr=42 min=1 max=815
Safeguard: keep additional 1 states
Emax=10.00013826903024 nrkept=1626 nrkeptmult=4036 
Total energy=-2.825850201865699  Egs=-1.444498395781826
Kept: 1626 out of 7056, ratio=0.23
Memory used: 89 MB  Time elapsed: 6 s

 ***** [NRG] Iteration 12/66 (scale 0.015939678853074835) ***** 
[1] xi(11)=0.01593578851722613 xi_scaled(11)=0.9997559338626226 zeta(12)=0
Stats: nr=42 min=1 max=633
Emax=10.04244342392892 nrkept=1737 nrkeptmult=4323 
Total energy=-2.840833289440475  Egs=-0.9399867910064672
Kept: 1737 out of 6132, ratio=0.283
Memory used: 92 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 13/66 (scale 0.011271055006945026) ***** 
[1] xi(12)=0.01126967935565226 xi_scaled(12)=0.9998779483116782 zeta(13)=0
Stats: nr=42 min=1 max=757
Emax=10.00181113466395 nrkept=1551 nrkeptmult=3816 
Total energy=-2.856820171778394  Egs=-1.418401589564472
Kept: 1551 out of 6545, ratio=0.237
Memory used: 96 MB  Time elapsed: 7 s

 ***** [NRG] Iteration 14/66 (scale 0.0079698394265374176) ***** 
[1] xi(13)=0.007969353023252924 xi_scaled(13)=0.9999389695000788 zeta(14)=0
Stats: nr=42 min=1 max=608
Safeguard: keep additional 1 states
Emax=10.01898122408278 nrkept=1626 nrkeptmult=4012 
Total energy=-2.864458096382014  Egs=-0.9583536373628048
Kept: 1626 out of 5842, ratio=0.278
Memory used: 96 MB  Time elapsed: 8 s

 ***** [NRG] Iteration 15/66 (scale 0.0056355275034725132) ***** 
[1] xi(14)=0.005635355527382068 xi_scaled(14)=0.9999694835859927 zeta(15)=0
Stats: nr=40 min=1 max=714
Emax=10.02376266463836 nrkept=1471 nrkeptmult=3644 
Total energy=-2.872317400863687  Egs=-1.394599614114359
Kept: 1471 out of 6121, ratio=0.24
Memory used: 96 MB  Time elapsed: 9 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=578
Safeguard: keep additional 3 states
Emax=10.00497600115539 nrkept=1440 nrkeptmult=3492 
Total energy=-2.876202252694471  Egs=-0.9748883566834219
Kept: 1440 out of 5538, ratio=0.26
Memory used: 96 MB  Time elapsed: 9 s

 ***** [NRG] Iteration 17/66 (scale 0.0028177637517362566) ***** 
[1] xi(16)=0.002817742254109917 xi_scaled(16)=0.9999923706782278 zeta(17)=0
Stats: nr=36 min=1 max=646
Emax=10.0045146613018 nrkept=1251 nrkeptmult=3088 
Total energy=-2.880067480123173  Egs=-1.371735805146928
Kept: 1251 out of 5417, ratio=0.231
Memory used: 96 MB  Time elapsed: 10 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=498
Emax=10.00129262789206 nrkept=1235 nrkeptmult=3031 
Total energy=-2.882044925009165  Egs=-0.9924641038098454
Kept: 1235 out of 4710, ratio=0.262
Memory used: 96 MB  Time elapsed: 10 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=559
Safeguard: keep additional 1 states
Emax=10.01391598153518 nrkept=1073 nrkeptmult=2688 
Total energy=-2.883942769580198  Egs=-1.347057268277584
Kept: 1073 out of 4649, ratio=0.231
Memory used: 96 MB  Time elapsed: 10 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=431
Safeguard: keep additional 2 states
Emax=10.00395033563442 nrkept=1060 nrkeptmult=2660 
Total energy=-2.884952690609763  Egs=-1.013742913015827
Kept: 1060 out of 4050, ratio=0.262
Memory used: 96 MB  Time elapsed: 11 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=475
Emax=10.01299311905627 nrkept=885 nrkeptmult=2260 
Total energy=-2.885881233332386  Egs=-1.318127145401114
Kept: 885 out of 4001, ratio=0.221
Memory used: 96 MB  Time elapsed: 11 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=363
Safeguard: keep additional 1 states
Emax=10.00027557031109 nrkept=898 nrkeptmult=2256 
Total energy=-2.886399529417311  Egs=-1.040514985932943
Kept: 898 out of 3352, ratio=0.268
Memory used: 96 MB  Time elapsed: 11 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=412
Safeguard: keep additional 1 states
Emax=10.0154335154628 nrkept=834 nrkeptmult=2140 
Total energy=-2.886851491322665  Egs=-1.283178989227065
Kept: 834 out of 3393, ratio=0.246
Memory used: 96 MB  Time elapsed: 11 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=344
Safeguard: keep additional 1 states
Emax=10.02033236266318 nrkept=846 nrkeptmult=2112 
Total energy=-2.887119046923246  Egs=-1.074272486604989
Kept: 846 out of 3158, ratio=0.268
Memory used: 96 MB  Time elapsed: 11 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=388
Safeguard: keep additional 2 states
Emax=10.00711461624963 nrkept=814 nrkeptmult=2080 
Total energy=-2.887337553683269  Egs=-1.240738567318258
Kept: 814 out of 3189, ratio=0.255
Memory used: 96 MB  Time elapsed: 11 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=332
Emax=10.00154752945071 nrkept=827 nrkeptmult=2055 
Total energy=-2.887476615303834  Egs=-1.116703014937934
Kept: 827 out of 3078, ratio=0.269
Memory used: 96 MB  Time elapsed: 12 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=383
Safeguard: keep additional 4 states
Emax=10.01120914005964 nrkept=811 nrkeptmult=2074 
Total energy=-2.887581358560776  Egs=-1.189519249108613
Kept: 811 out of 3117, ratio=0.26
Memory used: 96 MB  Time elapsed: 12 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=40 min=1 max=331
Safeguard: keep additional 4 states
Emax=10.00775747430858 nrkept=798 nrkeptmult=1988 
Total energy=-2.88765418556167  Egs=-1.169641647144141
Kept: 798 out of 3066, ratio=0.26
Memory used: 96 MB  Time elapsed: 12 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=368
Emax=10.00218858755347 nrkept=798 nrkeptmult=2036 
Total energy=-2.887703890869705  Egs=-1.128958988254272
Kept: 798 out of 3008, ratio=0.265
Memory used: 96 MB  Time elapsed: 12 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=329
Emax=10.00199074981101 nrkept=770 nrkeptmult=1936 
Total energy=-2.887742318153875  Egs=-1.234326593191365
Kept: 770 out of 3016, ratio=0.255
Memory used: 96 MB  Time elapsed: 12 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=34 min=1 max=354
Safeguard: keep additional 2 states
Emax=10.00660398648084 nrkept=797 nrkeptmult=2022 
Total energy=-2.887765665227697  Egs=-1.060566361277778
Kept: 797 out of 2905, ratio=0.274
Memory used: 96 MB  Time elapsed: 12 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=38 min=1 max=326
Safeguard: keep additional 1 states
Emax=10.01003939974174 nrkept=760 nrkeptmult=1922 
Total energy=-2.887786050903018  Egs=-1.309620584050036
Kept: 760 out of 3008, ratio=0.253
Memory used: 96 MB  Time elapsed: 12 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=34 min=1 max=348
Emax=10.00727011847739 nrkept=768 nrkeptmult=1926 
Total energy=-2.887796944242389  Egs=-0.9896837083215065
Kept: 768 out of 2872, ratio=0.267
Memory used: 96 MB  Time elapsed: 12 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=38 min=1 max=319
Safeguard: keep additional 3 states
Emax=10.00861574926107 nrkept=721 nrkeptmult=1795 
Total energy=-2.887807758994378  Egs=-1.389526870370328
Kept: 721 out of 2898, ratio=0.249
Memory used: 96 MB  Time elapsed: 13 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=332
Safeguard: keep additional 1 states
Emax=10.02232533817299 nrkept=728 nrkeptmult=1800 
Total energy=-2.887812851716006  Egs=-0.9253697979497054
Kept: 728 out of 2718, ratio=0.268
Memory used: 96 MB  Time elapsed: 13 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=304
Safeguard: keep additional 1 states
Emax=10.01334187110429 nrkept=658 nrkeptmult=1614 
Total energy=-2.887818545016983  Egs=-1.463000667751201
Kept: 658 out of 2744, ratio=0.24
Memory used: 96 MB  Time elapsed: 13 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=311
Safeguard: keep additional 1 states
Emax=10.00875168106388 nrkept=690 nrkeptmult=1694 
Total energy=-2.887820954964976  Egs=-0.8757961853498116
Kept: 690 out of 2481, ratio=0.278
Memory used: 96 MB  Time elapsed: 13 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=36 min=1 max=287
Safeguard: keep additional 2 states
Emax=10.01868744284235 nrkept=607 nrkeptmult=1461 
Total energy=-2.887823912027518  Egs=-1.519745571088869
Kept: 607 out of 2600, ratio=0.233
Memory used: 96 MB  Time elapsed: 13 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=292
Safeguard: keep additional 3 states
Emax=10.01279122354284 nrkept=619 nrkeptmult=1500 
Total energy=-2.88782507193922  Egs=-0.8430441214680774
Kept: 619 out of 2282, ratio=0.271
Memory used: 96 MB  Time elapsed: 13 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=36 min=1 max=260
Safeguard: keep additional 2 states
Emax=10.00052135559186 nrkept=549 nrkeptmult=1297 
Total energy=-2.887826586720068  Egs=-1.557005610349641
Kept: 549 out of 2326, ratio=0.236
Memory used: 96 MB  Time elapsed: 13 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=268
Emax=10.05482095304276 nrkept=570 nrkeptmult=1334 
Total energy=-2.88782715341423  Egs=-0.8237664665638894
Kept: 570 out of 2058, ratio=0.277
Memory used: 96 MB  Time elapsed: 13 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=245
Emax=10.00304856686698 nrkept=512 nrkeptmult=1190 
Total energy=-2.887827921378884  Egs=-1.57874358827444
Kept: 512 out of 2136, ratio=0.24
Memory used: 96 MB  Time elapsed: 13 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=251
Emax=10.33271811388258 nrkept=567 nrkeptmult=1322 
Total energy=-2.887828201099412  Egs=-0.8132230958800121
Kept: 567 out of 1914, ratio=0.296
Memory used: 96 MB  Time elapsed: 13 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=10.12932286580274 nrkept=499 nrkeptmult=1149 
Total energy=-2.887828587951518  Egs=-1.59054268665338
Kept: 499 out of 2124, ratio=0.235
Memory used: 96 MB  Time elapsed: 13 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=10.63729182063247 nrkept=567 nrkeptmult=1322 
Total energy=-2.887828726861109  Egs=-0.8076953721211595
Kept: 567 out of 1862, ratio=0.305
Memory used: 96 MB  Time elapsed: 13 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
Safeguard: keep additional 1 states
Emax=10.35951468752431 nrkept=499 nrkeptmult=1149 
Total energy=-2.887828921035622  Egs=-1.596697268185542
Kept: 499 out of 2124, ratio=0.235
Memory used: 96 MB  Time elapsed: 14 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=245
Emax=10.73721450847528 nrkept=567 nrkeptmult=1322 
Total energy=-2.887828990246861  Egs=-0.8048630364675041
Kept: 567 out of 1862, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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
Safeguard: keep additional 1 states
Emax=10.48978448138955 nrkept=499 nrkeptmult=1149 
Total energy=-2.887829087525294  Egs=-1.599841363763026
Kept: 499 out of 2124, ratio=0.235
Memory used: 96 MB  Time elapsed: 14 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=245
Emax=10.78934166897279 nrkept=567 nrkeptmult=1322 
Total energy=-2.887829122069262  Egs=-0.8034291315253943
Kept: 567 out of 1862, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=10.51116303408672 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829170756793  Egs=-1.601430508987447
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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=10.8156624930457 nrkept=567 nrkeptmult=1322 
Total energy=-2.887829188013267  Egs=-0.8027076629743735
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=244
Emax=10.51859228233775 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829212369176  Egs=-1.602229406476874
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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=10.82862194341597 nrkept=567 nrkeptmult=1322 
Total energy=-2.887829220993523  Egs=-0.8023457891408617
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=244
Emax=10.52232539066038 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829233174522  Egs=-1.602629942825719
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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=10.83336011730517 nrkept=567 nrkeptmult=1324 
Total energy=-2.887829237485722  Egs=-0.8021645660016503
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=10.5242084014011 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829243576984  Egs=-1.602830483698604
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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=10.83550463622787 nrkept=567 nrkeptmult=1324 
Total energy=-2.88782924573234  Egs=-0.8020738827098401
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=10.52514573001465 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829248778162  Egs=-1.602930822408992
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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=10.83657571802176 nrkept=567 nrkeptmult=1324 
Total energy=-2.887829249855779  Egs=-0.8020285231129405
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=10.52561470269243 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829251378737  Egs=-1.602981008844728
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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
Emax=10.83711095726136 nrkept=567 nrkeptmult=1324 
Total energy=-2.887829251917531  Egs=-0.8020058388244978
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=243
Emax=10.52584926621802 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829252679022  Egs=-1.603006106334042
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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
Emax=10.83737850206201 nrkept=567 nrkeptmult=1324 
Total energy=-2.887829252948415  Egs=-0.8019944955576226
Kept: 567 out of 1857, ratio=0.305
Memory used: 96 MB  Time elapsed: 14 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=243
Emax=10.52596656728216 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829253329164  Egs=-1.60301865614662
Kept: 498 out of 2124, ratio=0.234
Memory used: 96 MB  Time elapsed: 14 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 2 states
Emax=10.83751745352527 nrkept=569 nrkeptmult=1330 
Total energy=-2.887829253463859  Egs=-0.8019888236435888
Kept: 569 out of 1857, ratio=0.306
Memory used: 96 MB  Time elapsed: 15 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=244
Emax=10.5260252226384 nrkept=498 nrkeptmult=1142 
Total energy=-2.887829253654234  Egs=-1.603024931319855
Kept: 498 out of 2132, ratio=0.234
Memory used: 96 MB  Time elapsed: 15 s

** Iteration completed.


Total energy:             -2.887829253654234
TKW=3.210688178087679e-06

Memory usage report
===================
  after diag: 108308 kB
after recalc: 111208 kB
 after split: 111208 kB
  after trim: 99012 kB
 after trunc: 108308 kB
      diag_h: 108308 kB

Peak usage: 111208 kB

Timing report
=============
         All: 15 s
        diag: 14 s
    recalc f: 0 s
       Other: 0 s
