
  ___ ___ ___ _ _ _  
 |   |   |_  | | | | 
 | | | | | . | | | | 
 |__ |  _|___|_____|  22.1.0
 |___|_|             

User:   lacmarco@node494.cluster
Date:   Mon Mar 27 11:15:19 2023
Arch:   x86_64
Pid:    43989
Python: 3.10.4
gpaw:   /groups/kemi/lacmarco/miniconda3/envs/gpaw22/lib/python3.10/site-packages/gpaw
_gpaw:  /groups/kemi/lacmarco/miniconda3/envs/gpaw22/lib/python3.10/site-packages/
        _gpaw.cpython-310-x86_64-linux-gnu.so
ase:    /groups/kemi/lacmarco/miniconda3/envs/gpaw22/lib/python3.10/site-packages/ase (version 3.22.1)
numpy:  /groups/kemi/lacmarco/miniconda3/envs/gpaw22/lib/python3.10/site-packages/numpy (version 1.23.1)
scipy:  /groups/kemi/lacmarco/miniconda3/envs/gpaw22/lib/python3.10/site-packages/scipy (version 1.9.0)
libxc:  5.2.3
units:  Angstrom and eV
cores: 16
OpenMP: True
OMP_NUM_THREADS: 1

Input parameters:
  kpts: [4 4 1]
  mode: {ecut: 400.0,
         name: pw}
  xc: RPBE

System changes: positions, numbers, cell, pbc, initial_charges, initial_magmoms 

Initialize ...

Au-setup:
  name: Gold
  id: f729301af73151f9133db6f6e28f92a1
  Z: 79.0
  valence: 11
  core: 68
  charge: 0.0
  file: /groups/kemi/lacmarco/miniconda3/envs/gpaw22/share/gpaw/Au.RPBE.gz
  compensation charges: gauss, rc=0.42, lmax=2
  cutoffs: 2.33(filt), 2.81(core),
  valence states:
                energy  radius
    6s(1.00)    -5.611   1.323
    6p(0.00)    -0.793   1.323
    5d(10.00)    -6.824   1.323
    *s          21.600   1.323
    *p          26.419   1.323
    *d          20.388   1.323

  Using partial waves for Au as LCAO basis

Pd-setup:
  name: Palladium
  id: 6da19bfba079f22767af9506641940b9
  Z: 46.0
  valence: 16
  core: 30
  charge: 0.0
  file: /groups/kemi/lacmarco/miniconda3/envs/gpaw22/share/gpaw/Pd.RPBE.gz
  compensation charges: gauss, rc=0.38, lmax=2
  cutoffs: 2.38(filt), 2.28(core),
  valence states:
                energy  radius
    5s(0.00)    -3.225   1.228
    4p(6.00)   -51.131   1.360
    5p(0.00)    -0.373   1.360
    4d(10.00)    -3.964   1.228
    *s          23.987   1.228
    *d          23.247   1.228

  Using partial waves for Pd as LCAO basis

Reference energy: -8661686.411014

Spin-paired calculation

Convergence criteria:
 Maximum [total energy] change in last 3 cyles: 0.0005 eV / electron
 Maximum integral of absolute [dens]ity change: 0.0001 electrons / valence electron
 Maximum integral of absolute [eigenst]ate change: 4e-08 eV^2 / valence electron
 Maximum number of scf [iter]ations: 333
 (Square brackets indicate name in SCF output, whereas a 'c' in
 the SCF output indicates the quantity has converged.)

Symmetries present (total): 1

  ( 1  0  0)
  ( 0  1  0)
  ( 0  0  1)

16 k-points: 4 x 4 x 1 Monkhorst-Pack grid
8 k-points in the irreducible part of the Brillouin zone
       k-points in crystal coordinates                weights
   0:     0.12500000   -0.37500000    0.00000000          2/16
   1:     0.12500000   -0.12500000    0.00000000          2/16
   2:     0.12500000    0.12500000    0.00000000          2/16
   3:     0.12500000    0.37500000    0.00000000          2/16
   4:     0.37500000   -0.37500000    0.00000000          2/16
   5:     0.37500000   -0.12500000    0.00000000          2/16
   6:     0.37500000    0.12500000    0.00000000          2/16
   7:     0.37500000    0.37500000    0.00000000          2/16

Wave functions: Plane wave expansion
  Cutoff energy: 400.000 eV
  Number of coefficients (min, max): 35093, 35158
  Pulay-stress correction: 0.000000 eV/Ang^3 (de/decut=0.000000)
  Using FFTW library
  ScaLapack parameters: grid=1x1, blocksize=None
  Wavefunction extrapolation:
    Improved wavefunction reuse through dual PAW basis 

Occupation numbers: Fermi-Dirac: width=0.1000 eV
 

Eigensolver
   Davidson(niter=2) 

Densities:
  Coarse grid: 40*40*140 grid
  Fine grid: 80*80*280 grid
  Total Charge: 0.000000 

Density mixing:
  Method: separate
  Backend: pulay
  Linear mixing parameter: 0.05
  Mixing with 5 old densities
  Damping of long wave oscillations: 50 

Hamiltonian:
  XC and Coulomb potentials evaluated on a 80*80*280 grid
  Using the RPBE Exchange-Correlation functional
  External potential:
    NoExternalPotential
 

XC parameters: RPBE with 2 nearest neighbor stencil

Memory estimate:
  Process memory now: 183.39 MiB
  Calculator: 508.25 MiB
    Density: 54.04 MiB
      Arrays: 22.22 MiB
      Localized functions: 23.28 MiB
      Mixer: 8.54 MiB
    Hamiltonian: 15.09 MiB
      Arrays: 14.53 MiB
      XC: 0.00 MiB
      Poisson: 0.00 MiB
      vbar: 0.57 MiB
    Wavefunctions: 439.12 MiB
      Arrays psit_nG: 200.64 MiB
      Eigensolver: 224.68 MiB
      Projections: 2.11 MiB
      Projectors: 2.82 MiB
      PW-descriptor: 8.88 MiB

Total number of cores used: 16
Parallelization over k-points: 8
Domain decomposition: 1 x 1 x 2

Number of atoms: 41
Number of atomic orbitals: 468
Number of bands in calculation: 374
Number of valence electrons: 616
Bands to converge: occupied

... initialized

Initializing position-dependent things.

Density initialized from atomic densities
Creating initial wave functions:
  374 bands from LCAO basis set

      .-------------------.  
     /|                   |  
    / |                   |  
   /  |                   |  
  /   |                   |  
 *    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |         Pd        |  
 |    |Pd        Pd       |  
 |    |    Au        Pd   |  
 |    |                   |  
 |   Pd     Pd Pd     Pd  |  
 |    PdPd      PdAu      |  
 |    |Pd Pd     Au Pd    |  
 | Au |    PdPd      Pd   |  
 |   Au     Pd Pd     Pd  |  
 |    |                   |  
 |    PdPd      PdPd      |  
 |    |Pd Pd     Au Pd    |  
 | Pd |    PdPd      Au   |  
 |   Pd        Pd         |  
 |    |                   |  
 |    | Au        Pd      |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    .-------------------.  
 |   /                   /   
 |  /                   /    
 | /                   /     
 |/                   /      
 *-------------------*       

Positions:
   0 Au     2.988209    0.000000   10.000000    ( 0.0000,  0.0000,  0.0000)
   1 Pd     4.993657    2.005447   10.000000    ( 0.0000,  0.0000,  0.0000)
   2 Pd     2.988209    2.005447   12.005447    ( 0.0000,  0.0000,  0.0000)
   3 Pd     4.993657    0.000000   12.005447    ( 0.0000,  0.0000,  0.0000)
   4 Pd     2.988209    0.000000   14.010895    ( 0.0000,  0.0000,  0.0000)
   5 Pd     4.993657    2.005447   14.010895    ( 0.0000,  0.0000,  0.0000)
   6 Pd     2.988209    2.005447   16.016342    ( 0.0000,  0.0000,  0.0000)
   7 Pd     4.993657    0.000000   16.016342    ( 0.0000,  0.0000,  0.0000)
   8 Pd     2.988209    0.000000   18.021790    ( 0.0000,  0.0000,  0.0000)
   9 Pd     4.993657    2.005447   18.021790    ( 0.0000,  0.0000,  0.0000)
  10 Pd     2.988209    4.010895   10.000000    ( 0.0000,  0.0000,  0.0000)
  11 Au     4.993657    6.016342   10.000000    ( 0.0000,  0.0000,  0.0000)
  12 Pd     2.988209    6.016342   12.005447    ( 0.0000,  0.0000,  0.0000)
  13 Pd     4.993657    4.010895   12.005447    ( 0.0000,  0.0000,  0.0000)
  14 Pd     2.988209    4.010895   14.010895    ( 0.0000,  0.0000,  0.0000)
  15 Au     4.993657    6.016342   14.010895    ( 0.0000,  0.0000,  0.0000)
  16 Pd     2.988209    6.016342   16.016342    ( 0.0000,  0.0000,  0.0000)
  17 Pd     4.993657    4.010895   16.016342    ( 0.0000,  0.0000,  0.0000)
  18 Au     2.988209    4.010895   18.021790    ( 0.0000,  0.0000,  0.0000)
  19 Pd     4.993657    6.016342   18.021790    ( 0.0000,  0.0000,  0.0000)
  20 Pd     4.993657    4.010895   20.027237    ( 0.0000,  0.0000,  0.0000)
  21 Pd     6.999104    0.000000   10.000000    ( 0.0000,  0.0000,  0.0000)
  22 Pd     0.982762    2.005447   10.000000    ( 0.0000,  0.0000,  0.0000)
  23 Pd     6.999104    2.005447   12.005447    ( 0.0000,  0.0000,  0.0000)
  24 Pd     0.982762    0.000000   12.005447    ( 0.0000,  0.0000,  0.0000)
  25 Pd     6.999104    0.000000   14.010895    ( 0.0000,  0.0000,  0.0000)
  26 Au     0.982762    2.005447   14.010895    ( 0.0000,  0.0000,  0.0000)
  27 Pd     6.999104    2.005447   16.016342    ( 0.0000,  0.0000,  0.0000)
  28 Au     0.982762    0.000000   16.016342    ( 0.0000,  0.0000,  0.0000)
  29 Au     6.999104    0.000000   18.021790    ( 0.0000,  0.0000,  0.0000)
  30 Pd     0.982762    2.005447   18.021790    ( 0.0000,  0.0000,  0.0000)
  31 Au     6.999104    4.010895   10.000000    ( 0.0000,  0.0000,  0.0000)
  32 Pd     0.982762    6.016342   10.000000    ( 0.0000,  0.0000,  0.0000)
  33 Pd     6.999104    6.016342   12.005447    ( 0.0000,  0.0000,  0.0000)
  34 Pd     0.982762    4.010895   12.005447    ( 0.0000,  0.0000,  0.0000)
  35 Pd     6.999104    4.010895   14.010895    ( 0.0000,  0.0000,  0.0000)
  36 Pd     0.982762    6.016342   14.010895    ( 0.0000,  0.0000,  0.0000)
  37 Pd     6.999104    6.016342   16.016342    ( 0.0000,  0.0000,  0.0000)
  38 Pd     0.982762    4.010895   16.016342    ( 0.0000,  0.0000,  0.0000)
  39 Pd     6.999104    4.010895   18.021790    ( 0.0000,  0.0000,  0.0000)
  40 Pd     0.982762    6.016342   18.021790    ( 0.0000,  0.0000,  0.0000)

Unit cell:
           periodic     x           y           z      points  spacing
  1. axis:    yes    8.021790    0.000000    0.000000    40     0.2005
  2. axis:    yes    0.000000    8.021790    0.000000    40     0.2005
  3. axis:    no     0.000000    0.000000   30.027237   140     0.2145

  Lengths:   8.021790   8.021790  30.027237
  Angles:   90.000000  90.000000  90.000000

Effective grid spacing dv^(1/3) = 0.2051

     iter     time        total  log10-change:
                         energy  eigst   dens
iter:   1 11:17:44  -153.777031
iter:   2 11:18:45  -144.129827  -1.26  -1.20
iter:   3 11:19:39  -140.094807  -1.63  -1.26
iter:   4 11:20:34  -204.987813  -0.72  -1.29
iter:   5 11:21:41  -143.838314  -0.82  -1.17
iter:   6 11:22:38  -127.618325  -1.48  -1.58
iter:   7 11:23:32  -122.700163  -1.62  -1.77
iter:   8 11:24:26  -122.011843  -2.31  -1.78
iter:   9 11:25:21  -119.736145  -2.02  -1.86
iter:  10 11:26:15  -118.570047  -2.42  -1.97
iter:  11 11:27:17  -118.471391  -2.90  -2.10
iter:  12 11:28:15  -118.343679c -2.83  -2.16
iter:  13 11:29:34  -118.345708c -3.14  -2.23
iter:  14 11:30:45  -118.270320c -3.25  -2.24
iter:  15 11:31:39  -118.245433c -3.08  -2.34
iter:  16 11:32:33  -118.127019c -3.51  -2.42
iter:  17 11:33:27  -118.105030c -3.88  -2.56
iter:  18 11:34:23  -118.099782c -3.85  -2.71
iter:  19 11:35:20  -118.087486c -3.96  -2.79
iter:  20 11:36:16  -118.088163c -4.73  -2.98
iter:  21 11:37:12  -118.084014c -4.38  -3.01
iter:  22 11:38:07  -118.080503c -4.84  -3.12
iter:  23 11:39:02  -118.080580c -5.23  -3.23
iter:  24 11:39:56  -118.079339c -5.13  -3.27
iter:  25 11:40:49  -118.079479c -5.15  -3.37
iter:  26 11:41:44  -118.079661c -5.52  -3.46
iter:  27 11:42:40  -118.079321c -5.44  -3.49
iter:  28 11:43:35  -118.078966c -6.14  -3.55
iter:  29 11:44:30  -118.078754c -6.02  -3.64
iter:  30 11:45:23  -118.078634c -5.59  -3.73
iter:  31 11:46:18  -118.078650c -6.32  -3.87
iter:  32 11:47:14  -118.078752c -6.25  -3.99
iter:  33 11:48:09  -118.078740c -6.58  -4.21c
iter:  34 11:49:04  -118.078725c -7.28  -4.40c
iter:  35 11:49:59  -118.078688c -7.57c -4.42c

Converged after 35 iterations.

Dipole moment: (-3.997114, 0.027041, 0.240042) |e|*Ang

Energy contributions relative to reference atoms: (reference = -8661686.411014)

Kinetic:       -199.053951
Potential:      +23.599564
External:        +0.000000
XC:             +61.578282
Entropy (-ST):   -2.342217
Local:           -3.031474
--------------------------
Free energy:   -119.249796
Extrapolated:  -118.078688

Showing only first 2 kpts
 Kpt  Band  Eigenvalues  Occupancy
  0   306     -0.27719    1.31727
  0   307     -0.24920    1.18646
  0   308     -0.23493    1.11677
  0   309     -0.21304    1.00789

  1   306     -0.24248    1.15384
  1   307     -0.22559    1.07048
  1   308     -0.21774    1.03136
  1   309     -0.17374    0.81359


Fermi level: -0.21147

No gap

Forces in eV/Ang:
  0 Au   -0.11523    0.11993   -0.33682
  1 Pd    0.00070   -0.00247    0.13340
  2 Pd    0.11125    0.16046   -0.04297
  3 Pd    0.14237    0.26895    0.06949
  4 Pd    0.13884   -0.00712   -0.15153
  5 Pd    0.00672    0.02224    0.01300
  6 Pd    0.22336   -0.05261    0.02853
  7 Pd   -0.18455    0.13305    0.14873
  8 Pd    0.16774    0.00138   -0.11630
  9 Pd    0.04837   -0.02315    0.12945
 10 Pd   -0.09364   -0.09095    0.21368
 11 Au   -0.00016    0.00319   -0.36354
 12 Pd   -0.28159   -0.14223    0.08018
 13 Pd   -0.15015   -0.27169    0.04860
 14 Pd    0.02519   -0.00104    0.02245
 15 Au    0.00244   -0.01708    0.01696
 16 Pd   -0.03309    0.05147    0.03105
 17 Pd    0.14919   -0.13442   -0.03215
 18 Au   -0.10242    0.00055    0.56902
 19 Pd    0.04615    0.01746    0.12995
 20 Pd    0.06792   -0.00205   -1.04521
 21 Pd    0.08269    0.09206    0.20909
 22 Pd    0.00011    0.00261    0.13416
 23 Pd   -0.10812   -0.16708   -0.03886
 24 Pd   -0.16223   -0.11858   -0.08732
 25 Pd   -0.14368   -0.00110   -0.10747
 26 Au   -0.00247    0.17046   -0.19084
 27 Pd   -0.21750    0.25285    0.02832
 28 Au    0.20986   -0.16747    0.09651
 29 Au   -0.17883    0.00117    0.47506
 30 Pd   -0.03828    0.12024   -0.01146
 31 Au    0.12352   -0.12085   -0.33952
 32 Pd    0.00170   -0.00516    0.13171
 33 Pd    0.28971    0.16050    0.08755
 34 Pd    0.16146    0.10964   -0.04759
 35 Pd   -0.01006    0.00548   -0.03427
 36 Pd   -0.00399   -0.13703   -0.12919
 37 Pd    0.04221   -0.25686    0.03528
 38 Pd   -0.12878    0.12780    0.16441
 39 Pd   -0.03186    0.00195    0.05571
 40 Pd   -0.04218   -0.10407   -0.02108

System changes: positions 

Initializing position-dependent things.

Density initialized from wave functions
      .-------------------.  
     /|                   |  
    / |                   |  
   /  |                   |  
  /   |                   |  
 *    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |         Pd        |  
 |    |Pd        Pd       |  
 |    | Au Au        Pd   |  
 |    |                   |  
 |   Pd     Pd Pd     Pd  |  
 |    PdPd   Pd PdAu   Pd |  
 |    |Pd Pd     Au Pd    |  
 |    | Pd PdPd      Pd   |  
 |   Au     Pd Pd     Pd  |  
 |    |                   |  
 |    Pd        Pd        |  
 |    |Pd Pd     Au Pd    |  
 |    |    Pd Pd     Au   |  
 |   Pd        Pd         |  
 |    |                   |  
 |    | Au        Pd      |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    .-------------------.  
 |   /                   /   
 |  /                   /    
 | /                   /     
 |/                   /      
 *-------------------*       

Positions:
   0 Au     2.976686    0.011993    9.966318    ( 0.0000,  0.0000,  0.0000)
   1 Pd     4.993727    2.005200   10.013340    ( 0.0000,  0.0000,  0.0000)
   2 Pd     2.999334    2.021493   12.001151    ( 0.0000,  0.0000,  0.0000)
   3 Pd     5.007894    0.026895   12.012396    ( 0.0000,  0.0000,  0.0000)
   4 Pd     3.002093   -0.000712   13.995742    ( 0.0000,  0.0000,  0.0000)
   5 Pd     4.994329    2.007671   14.012195    ( 0.0000,  0.0000,  0.0000)
   6 Pd     3.010546    2.000186   16.019195    ( 0.0000,  0.0000,  0.0000)
   7 Pd     4.975201    0.013305   16.031215    ( 0.0000,  0.0000,  0.0000)
   8 Pd     3.004983    0.000138   18.010160    ( 0.0000,  0.0000,  0.0000)
   9 Pd     4.998494    2.003132   18.034734    ( 0.0000,  0.0000,  0.0000)
  10 Pd     2.978845    4.001799   10.021368    ( 0.0000,  0.0000,  0.0000)
  11 Au     4.993640    6.016661    9.963646    ( 0.0000,  0.0000,  0.0000)
  12 Pd     2.960050    6.002119   12.013466    ( 0.0000,  0.0000,  0.0000)
  13 Pd     4.978641    3.983726   12.010308    ( 0.0000,  0.0000,  0.0000)
  14 Pd     2.990728    4.010790   14.013140    ( 0.0000,  0.0000,  0.0000)
  15 Au     4.993900    6.014634   14.012591    ( 0.0000,  0.0000,  0.0000)
  16 Pd     2.984900    6.021489   16.019448    ( 0.0000,  0.0000,  0.0000)
  17 Pd     5.008575    3.997453   16.013128    ( 0.0000,  0.0000,  0.0000)
  18 Au     2.977967    4.010949   18.078692    ( 0.0000,  0.0000,  0.0000)
  19 Pd     4.998272    6.018088   18.034785    ( 0.0000,  0.0000,  0.0000)
  20 Pd     5.000448    4.010689   19.922716    ( 0.0000,  0.0000,  0.0000)
  21 Pd     7.007373    0.009206   10.020909    ( 0.0000,  0.0000,  0.0000)
  22 Pd     0.982772    2.005709   10.013416    ( 0.0000,  0.0000,  0.0000)
  23 Pd     6.988292    1.988739   12.001562    ( 0.0000,  0.0000,  0.0000)
  24 Pd     0.966538   -0.011858   11.996715    ( 0.0000,  0.0000,  0.0000)
  25 Pd     6.984736   -0.000110   14.000148    ( 0.0000,  0.0000,  0.0000)
  26 Au     0.982515    2.022494   13.991810    ( 0.0000,  0.0000,  0.0000)
  27 Pd     6.977354    2.030733   16.019174    ( 0.0000,  0.0000,  0.0000)
  28 Au     1.003747   -0.016747   16.025993    ( 0.0000,  0.0000,  0.0000)
  29 Au     6.981221    0.000117   18.069295    ( 0.0000,  0.0000,  0.0000)
  30 Pd     0.978934    2.017471   18.020643    ( 0.0000,  0.0000,  0.0000)
  31 Au     7.011455    3.998809    9.966048    ( 0.0000,  0.0000,  0.0000)
  32 Pd     0.982931    6.015826   10.013171    ( 0.0000,  0.0000,  0.0000)
  33 Pd     7.028075    6.032392   12.014203    ( 0.0000,  0.0000,  0.0000)
  34 Pd     0.998908    4.021859   12.000688    ( 0.0000,  0.0000,  0.0000)
  35 Pd     6.998098    4.011443   14.007467    ( 0.0000,  0.0000,  0.0000)
  36 Pd     0.982363    6.002639   13.997976    ( 0.0000,  0.0000,  0.0000)
  37 Pd     7.003325    5.990656   16.019870    ( 0.0000,  0.0000,  0.0000)
  38 Pd     0.969883    4.023674   16.032784    ( 0.0000,  0.0000,  0.0000)
  39 Pd     6.995918    4.011089   18.027360    ( 0.0000,  0.0000,  0.0000)
  40 Pd     0.978543    6.005935   18.019682    ( 0.0000,  0.0000,  0.0000)

Unit cell:
           periodic     x           y           z      points  spacing
  1. axis:    yes    8.021790    0.000000    0.000000    40     0.2005
  2. axis:    yes    0.000000    8.021790    0.000000    40     0.2005
  3. axis:    no     0.000000    0.000000   30.027237   140     0.2145

  Lengths:   8.021790   8.021790  30.027237
  Angles:   90.000000  90.000000  90.000000

Effective grid spacing dv^(1/3) = 0.2051

     iter     time        total  log10-change:
                         energy  eigst   dens
iter:   1 11:51:23  -121.431305  -1.71
iter:   2 11:52:17  -148.557542  -1.38  -1.95
iter:   3 11:53:12  -121.556537  -1.80  -1.51
iter:   4 11:54:06  -118.955433  -2.39  -2.04
iter:   5 11:54:59  -118.488316  -2.99  -2.42
iter:   6 11:55:54  -118.476804  -3.74  -2.60
iter:   7 11:56:47  -118.345483c -3.19  -2.58
iter:   8 11:57:49  -118.318259c -4.10  -2.76
iter:   9 11:58:43  -118.295573c -3.68  -2.85
iter:  10 11:59:37  -118.291551c -4.24  -3.01
iter:  11 12:00:34  -118.289966c -4.89  -3.16
iter:  12 12:01:29  -118.293987c -5.06  -3.21
iter:  13 12:02:32  -118.288585c -5.29  -3.13
iter:  14 12:03:33  -118.288564c -4.84  -3.33
iter:  15 12:04:30  -118.288724c -4.91  -3.45
iter:  16 12:05:25  -118.288103c -5.61  -3.54
iter:  17 12:06:35  -118.287910c -5.65  -3.73
iter:  18 12:07:31  -118.287654c -5.56  -3.87
iter:  19 12:08:26  -118.287822c -6.05  -4.12c
iter:  20 12:09:19  -118.287532c -6.54  -3.90
iter:  21 12:10:18  -118.287460c -6.81  -4.25c
iter:  22 12:11:21  -118.287443c -6.86  -4.36c
iter:  23 12:12:29  -118.287458c -7.02  -4.47c
iter:  24 12:13:24  -118.287483c -7.47c -4.56c

Converged after 24 iterations.

Dipole moment: (-4.086714, -1.446159, 0.232135) |e|*Ang

Energy contributions relative to reference atoms: (reference = -8661686.411014)

Kinetic:       -202.102997
Potential:      +25.966078
External:        +0.000000
XC:             +62.083120
Entropy (-ST):   -2.344519
Local:           -3.061423
--------------------------
Free energy:   -119.459743
Extrapolated:  -118.287483

Showing only first 2 kpts
 Kpt  Band  Eigenvalues  Occupancy
  0   306     -0.27842    1.28530
  0   307     -0.25566    1.17774
  0   308     -0.23988    1.10037
  0   309     -0.22669    1.03474

  1   306     -0.25344    1.16697
  1   307     -0.23258    1.06412
  1   308     -0.22760    1.03933
  1   309     -0.18370    0.82177


Fermi level: -0.21973

No gap

Forces in eV/Ang:
  0 Au   -0.01525    0.02330   -0.11277
  1 Pd    0.00084   -0.00230    0.00328
  2 Pd   -0.02157   -0.06449   -0.01437
  3 Pd   -0.08503   -0.05859   -0.08622
  4 Pd   -0.01112    0.02981   -0.12372
  5 Pd    0.00533    0.01421    0.03252
  6 Pd   -0.00985    0.10175    0.03257
  7 Pd    0.06593   -0.01506    0.07724
  8 Pd    0.08925    0.00416    0.01296
  9 Pd    0.01410   -0.08465    0.04774
 10 Pd   -0.03070   -0.02781    0.07140
 11 Au    0.00193    0.00033   -0.03091
 12 Pd    0.06926    0.07184   -0.06101
 13 Pd    0.07968    0.06090   -0.06417
 14 Pd    0.01795   -0.00221    0.13958
 15 Au    0.00476   -0.01184   -0.04244
 16 Pd    0.06241   -0.13307    0.04741
 17 Pd   -0.09440    0.00994    0.08611
 18 Au   -0.21104    0.00250    0.12637
 19 Pd    0.01238    0.08287   -0.05181
 20 Pd    0.14545   -0.00570   -0.47992
 21 Pd    0.01641    0.02874    0.06728
 22 Pd   -0.00100    0.00683    0.10344
 23 Pd    0.02311    0.07796   -0.01750
 24 Pd    0.07215    0.04745    0.00771
 25 Pd    0.02238    0.02905    0.17498
 26 Au   -0.00231   -0.03836    0.04683
 27 Pd    0.04650   -0.08558    0.02432
 28 Au   -0.13466    0.07453   -0.02189
 29 Au   -0.02013    0.00475    0.16934
 30 Pd   -0.05436    0.01724   -0.07185
 31 Au    0.02504   -0.02228   -0.10810
 32 Pd   -0.00004   -0.00955   -0.00102
 33 Pd   -0.06602   -0.08673   -0.06367
 34 Pd   -0.07139   -0.02997   -0.05253
 35 Pd   -0.00198   -0.00169   -0.13353
 36 Pd   -0.00306   -0.01601    0.05581
 37 Pd   -0.01739    0.06037    0.04132
 38 Pd    0.06189   -0.03028    0.09220
 39 Pd    0.08144    0.00144    0.01843
 40 Pd   -0.05519   -0.02558    0.05252

System changes: positions 

Initializing position-dependent things.

Density initialized from wave functions
      .-------------------.  
     /|                   |  
    / |                   |  
   /  |                   |  
  /   |                   |  
 *    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |         Pd        |  
 |    |Pd        Pd       |  
 |    | Au Au        Pd   |  
 |    |                   |  
 |   Pd     Pd Pd     Pd  |  
 |    Pd Pd     PdAu      |  
 |    |Pd Pd     Au Pd    |  
 |    | Pd PdPd      Pd   |  
 |   Au     Pd Pd     Pd  |  
 |    |                   |  
 |    PdPd      PdPd      |  
 |    |Pd Pd     Au Pd    |  
 |    |    PdPd      Au   |  
 |   Pd        Pd         |  
 |    |                   |  
 |    | Au        Pd      |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    .-------------------.  
 |   /                   /   
 |  /                   /    
 | /                   /     
 |/                   /      
 *-------------------*       

Positions:
   0 Au     2.972037    0.017701    9.944753    ( 0.0000,  0.0000,  0.0000)
   1 Pd     4.993842    2.004870   10.017042    ( 0.0000,  0.0000,  0.0000)
   2 Pd     2.999580    2.017944   11.998402    ( 0.0000,  0.0000,  0.0000)
   3 Pd     5.001494    0.026735   12.004043    ( 0.0000,  0.0000,  0.0000)
   4 Pd     3.004247    0.002596   13.977506    ( 0.0000,  0.0000,  0.0000)
   5 Pd     4.995119    2.009885   14.016320    ( 0.0000,  0.0000,  0.0000)
   6 Pd     3.014950    2.010774   16.023713    ( 0.0000,  0.0000,  0.0000)
   7 Pd     4.978319    0.014853   16.043946    ( 0.0000,  0.0000,  0.0000)
   8 Pd     3.019591    0.000659   18.008782    ( 0.0000,  0.0000,  0.0000)
   9 Pd     5.001346    1.992659   18.043537    ( 0.0000,  0.0000,  0.0000)
  10 Pd     2.972926    3.996285   10.035032    ( 0.0000,  0.0000,  0.0000)
  11 Au     4.993861    6.016779    9.950989    ( 0.0000,  0.0000,  0.0000)
  12 Pd     2.961144    6.006981   12.008326    ( 0.0000,  0.0000,  0.0000)
  13 Pd     4.984223    3.984088   12.004014    ( 0.0000,  0.0000,  0.0000)
  14 Pd     2.993453    4.010506   14.030019    ( 0.0000,  0.0000,  0.0000)
  15 Au     4.994518    6.012825   14.008050    ( 0.0000,  0.0000,  0.0000)
  16 Pd     2.991375    6.007210   16.025763    ( 0.0000,  0.0000,  0.0000)
  17 Pd     5.001248    3.995272   16.022396    ( 0.0000,  0.0000,  0.0000)
  18 Au     2.950744    4.011256   18.107623    ( 0.0000,  0.0000,  0.0000)
  19 Pd     5.000867    6.028211   18.031960    ( 0.0000,  0.0000,  0.0000)
  20 Pd     5.019145    4.009972   19.840602    ( 0.0000,  0.0000,  0.0000)
  21 Pd     7.011348    0.014857   10.033977    ( 0.0000,  0.0000,  0.0000)
  22 Pd     0.982659    2.006573   10.028848    ( 0.0000,  0.0000,  0.0000)
  23 Pd     6.988305    1.993699   11.998549    ( 0.0000,  0.0000,  0.0000)
  24 Pd     0.970939   -0.009259   11.995444    ( 0.0000,  0.0000,  0.0000)
  25 Pd     6.983779    0.003260   14.017934    ( 0.0000,  0.0000,  0.0000)
  26 Au     0.982184    2.022249   13.992539    ( 0.0000,  0.0000,  0.0000)
  27 Pd     6.977380    2.027016   16.022722    ( 0.0000,  0.0000,  0.0000)
  28 Au     0.993222   -0.012198   16.025835    ( 0.0000,  0.0000,  0.0000)
  29 Au     6.974419    0.000701   18.100913    ( 0.0000,  0.0000,  0.0000)
  30 Pd     0.971626    2.022479   18.011957    ( 0.0000,  0.0000,  0.0000)
  31 Au     7.017456    3.993198    9.944963    ( 0.0000,  0.0000,  0.0000)
  32 Pd     0.982970    6.014581   10.016328    ( 0.0000,  0.0000,  0.0000)
  33 Pd     7.027563    6.026244   12.008936    ( 0.0000,  0.0000,  0.0000)
  34 Pd     0.994577    4.021082   11.993363    ( 0.0000,  0.0000,  0.0000)
  35 Pd     6.997616    4.011381   13.991002    ( 0.0000,  0.0000,  0.0000)
  36 Pd     0.981906    5.997358   14.001288    ( 0.0000,  0.0000,  0.0000)
  37 Pd     7.002341    5.991325   16.025579    ( 0.0000,  0.0000,  0.0000)
  38 Pd     0.973917    4.023313   16.047654    ( 0.0000,  0.0000,  0.0000)
  39 Pd     7.004647    4.011306   18.030901    ( 0.0000,  0.0000,  0.0000)
  40 Pd     0.971041    6.000356   18.025298    ( 0.0000,  0.0000,  0.0000)

Unit cell:
           periodic     x           y           z      points  spacing
  1. axis:    yes    8.021790    0.000000    0.000000    40     0.2005
  2. axis:    yes    0.000000    8.021790    0.000000    40     0.2005
  3. axis:    no     0.000000    0.000000   30.027237   140     0.2145

  Lengths:   8.021790   8.021790  30.027237
  Angles:   90.000000  90.000000  90.000000

Effective grid spacing dv^(1/3) = 0.2051

     iter     time        total  log10-change:
                         energy  eigst   dens
iter:   1 12:14:58  -119.865781  -2.14
iter:   2 12:16:05  -134.619111  -1.73  -2.12
iter:   3 12:17:14  -119.715435  -2.16  -1.66
iter:   4 12:18:35  -118.562336  -2.79  -2.23
iter:   5 12:19:39  -118.389780  -3.45  -2.65
iter:   6 12:20:35  -118.396165c -4.27  -2.94
iter:   7 12:21:31  -118.357624c -4.08  -2.90
iter:   8 12:22:25  -118.356346c -4.67  -3.15
iter:   9 12:23:20  -118.351617c -4.35  -3.19
iter:  10 12:24:15  -118.351664c -5.07  -3.44
iter:  11 12:25:15  -118.352152c -5.41  -3.50
iter:  12 12:26:11  -118.354152c -5.18  -3.47
iter:  13 12:27:06  -118.351382c -5.72  -3.38
iter:  14 12:28:06  -118.351545c -5.54  -3.77
iter:  15 12:29:20  -118.351439c -6.13  -3.87
iter:  16 12:30:16  -118.351012c -5.97  -3.94
iter:  17 12:31:11  -118.350961c -6.28  -4.28c
iter:  18 12:33:57  -118.350956c -6.79  -4.26c
iter:  19 12:35:09  -118.350989c -7.03  -4.40c
iter:  20 12:36:06  -118.350992c -7.30  -4.42c
iter:  21 12:37:02  -118.351025c -7.30  -4.59c
iter:  22 12:37:57  -118.351032c -7.60c -4.70c

Converged after 22 iterations.

Dipole moment: (-4.231114, -2.705994, 0.221149) |e|*Ang

Energy contributions relative to reference atoms: (reference = -8661686.411014)

Kinetic:       -202.654085
Potential:      +26.285343
External:        +0.000000
XC:             +62.219503
Entropy (-ST):   -2.339133
Local:           -3.032227
--------------------------
Free energy:   -119.520598
Extrapolated:  -118.351032

Showing only first 2 kpts
 Kpt  Band  Eigenvalues  Occupancy
  0   306     -0.28626    1.28094
  0   307     -0.26473    1.17911
  0   308     -0.24836    1.09887
  0   309     -0.23778    1.04629

  1   306     -0.26397    1.17542
  1   307     -0.23916    1.05314
  1   308     -0.23526    1.03371
  1   309     -0.19249    0.82179


Fermi level: -0.22852

No gap

Forces in eV/Ang:
  0 Au    0.00312   -0.00972   -0.07596
  1 Pd    0.00045    0.00541   -0.03399
  2 Pd   -0.00377   -0.01879    0.02902
  3 Pd   -0.01960   -0.07228   -0.04706
  4 Pd   -0.01965   -0.00273    0.04794
  5 Pd    0.00825   -0.00326    0.00627
  6 Pd   -0.04396    0.00374    0.04224
  7 Pd    0.03238   -0.03203   -0.01768
  8 Pd   -0.02522   -0.00164   -0.00844
  9 Pd   -0.01145   -0.10075   -0.05357
 10 Pd    0.00546   -0.00042    0.01753
 11 Au    0.00138   -0.00536   -0.00090
 12 Pd    0.06907    0.02749   -0.04837
 13 Pd    0.03211    0.07194   -0.06088
 14 Pd   -0.01105   -0.00298   -0.00656
 15 Au    0.00995    0.02169   -0.00324
 16 Pd   -0.00389    0.00926    0.03765
 17 Pd   -0.01428    0.02029    0.10315
 18 Au   -0.18060   -0.00309   -0.00148
 19 Pd   -0.01254    0.08779   -0.10080
 20 Pd    0.13221    0.01085   -0.04440
 21 Pd    0.00083    0.00007    0.02456
 22 Pd    0.00028   -0.00432    0.01742
 23 Pd    0.00171    0.03015    0.02964
 24 Pd    0.02704    0.00290    0.04275
 25 Pd   -0.01023   -0.00845    0.02179
 26 Au    0.01145    0.00055    0.05252
 27 Pd    0.02396   -0.02597    0.02226
 28 Au    0.01213   -0.00047    0.04366
 29 Au    0.05605   -0.00199    0.10076
 30 Pd   -0.04657   -0.06094   -0.01459
 31 Au   -0.01607    0.00939   -0.08020
 32 Pd    0.00078    0.00711   -0.02827
 33 Pd   -0.06989   -0.02108   -0.04762
 34 Pd   -0.02659   -0.01049    0.03055
 35 Pd    0.00624   -0.00557    0.01057
 36 Pd    0.00964    0.00831    0.04620
 37 Pd   -0.01888    0.03397    0.01516
 38 Pd   -0.00771   -0.02669   -0.01548
 39 Pd    0.15259   -0.00268   -0.10331
 40 Pd   -0.04775    0.07179    0.04095

System changes: positions 

Initializing position-dependent things.

Density initialized from wave functions
      .-------------------.  
     /|                   |  
    / |                   |  
   /  |                   |  
  /   |                   |  
 *    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |         Pd        |  
 |    |Pd        Pd       |  
 |    | Au Au        Pd   |  
 |    |                   |  
 |   Pd     Pd Pd     Pd  |  
 |    Pd Pd     PdAu      |  
 |    |Pd Pd     Au Pd    |  
 |    | Pd PdPd      Pd   |  
 |   Au     Pd Pd     Pd  |  
 |    |                   |  
 |    PdPd      PdPd      |  
 |    |Pd Pd     Au Pd    |  
 |    |    PdPd      Au   |  
 |   Pd        Pd         |  
 |    |                   |  
 |    | Au        Pd      |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    .-------------------.  
 |   /                   /   
 |  /                   /    
 | /                   /     
 |/                   /      
 *-------------------*       

Positions:
   0 Au     2.970173    0.019034    9.926281    ( 0.0000,  0.0000,  0.0000)
   1 Pd     4.993937    2.005457   10.014855    ( 0.0000,  0.0000,  0.0000)
   2 Pd     3.000179    2.016074   12.001028    ( 0.0000,  0.0000,  0.0000)
   3 Pd     4.998613    0.019859   11.996451    ( 0.0000,  0.0000,  0.0000)
   4 Pd     3.003551    0.003040   13.977542    ( 0.0000,  0.0000,  0.0000)
   5 Pd     4.996448    2.010246   14.018320    ( 0.0000,  0.0000,  0.0000)
   6 Pd     3.012488    2.013526   16.030585    ( 0.0000,  0.0000,  0.0000)
   7 Pd     4.981605    0.012355   16.046346    ( 0.0000,  0.0000,  0.0000)
   8 Pd     3.021684    0.000596   18.006270    ( 0.0000,  0.0000,  0.0000)
   9 Pd     5.001058    1.976758   18.040120    ( 0.0000,  0.0000,  0.0000)
  10 Pd     2.971230    3.993962   10.042801    ( 0.0000,  0.0000,  0.0000)
  11 Au     4.994095    6.016149    9.944248    ( 0.0000,  0.0000,  0.0000)
  12 Pd     2.967734    6.010479   12.001501    ( 0.0000,  0.0000,  0.0000)
  13 Pd     4.988429    3.990948   11.994989    ( 0.0000,  0.0000,  0.0000)
  14 Pd     2.992971    4.010039   14.033771    ( 0.0000,  0.0000,  0.0000)
  15 Au     4.995981    6.014989   14.006608    ( 0.0000,  0.0000,  0.0000)
  16 Pd     2.992255    6.005160   16.032535    ( 0.0000,  0.0000,  0.0000)
  17 Pd     4.998873    3.996082   16.037786    ( 0.0000,  0.0000,  0.0000)
  18 Au     2.919484    4.010943   18.120175    ( 0.0000,  0.0000,  0.0000)
  19 Pd     5.000352    6.042301   18.019446    ( 0.0000,  0.0000,  0.0000)
  20 Pd     5.041643    4.011162   19.803944    ( 0.0000,  0.0000,  0.0000)
  21 Pd     7.013247    0.017180   10.042454    ( 0.0000,  0.0000,  0.0000)
  22 Pd     0.982665    2.006265   10.036333    ( 0.0000,  0.0000,  0.0000)
  23 Pd     6.987537    1.997336   12.001223    ( 0.0000,  0.0000,  0.0000)
  24 Pd     0.974075   -0.009297   11.999814    ( 0.0000,  0.0000,  0.0000)
  25 Pd     6.980896    0.003038   14.024379    ( 0.0000,  0.0000,  0.0000)
  26 Au     0.983548    2.023819   13.997736    ( 0.0000,  0.0000,  0.0000)
  27 Pd     6.978476    2.025026   16.026768    ( 0.0000,  0.0000,  0.0000)
  28 Au     0.993970   -0.012611   16.032296    ( 0.0000,  0.0000,  0.0000)
  29 Au     6.978222    0.000608   18.126459    ( 0.0000,  0.0000,  0.0000)
  30 Pd     0.963382    2.017042   18.007715    ( 0.0000,  0.0000,  0.0000)
  31 Au     7.018081    3.991838    9.926045    ( 0.0000,  0.0000,  0.0000)
  32 Pd     0.983096    6.015125   10.014720    ( 0.0000,  0.0000,  0.0000)
  33 Pd     7.021093    6.023404   12.002242    ( 0.0000,  0.0000,  0.0000)
  34 Pd     0.991509    4.020535   11.994952    ( 0.0000,  0.0000,  0.0000)
  35 Pd     6.998202    4.010698   13.987766    ( 0.0000,  0.0000,  0.0000)
  36 Pd     0.982990    5.995798   14.006909    ( 0.0000,  0.0000,  0.0000)
  37 Pd     7.000044    5.993515   16.029338    ( 0.0000,  0.0000,  0.0000)
  38 Pd     0.972793    4.020957   16.051038    ( 0.0000,  0.0000,  0.0000)
  39 Pd     7.026260    4.011036   18.019040    ( 0.0000,  0.0000,  0.0000)
  40 Pd     0.962559    6.007187   18.031836    ( 0.0000,  0.0000,  0.0000)

Unit cell:
           periodic     x           y           z      points  spacing
  1. axis:    yes    8.021790    0.000000    0.000000    40     0.2005
  2. axis:    yes    0.000000    8.021790    0.000000    40     0.2005
  3. axis:    no     0.000000    0.000000   30.027237   140     0.2145

  Lengths:   8.021790   8.021790  30.027237
  Angles:   90.000000  90.000000  90.000000

Effective grid spacing dv^(1/3) = 0.2051

     iter     time        total  log10-change:
                         energy  eigst   dens
iter:   1 12:41:10  -119.432223  -2.46
iter:   2 12:42:04  -134.188393  -1.82  -2.18
iter:   3 12:42:59  -119.466927  -2.35  -1.66
iter:   4 12:43:55  -118.404931  -2.89  -2.29
iter:   5 12:44:57  -118.393445  -3.70  -3.01
iter:   6 12:46:02  -118.384236c -4.49  -3.01
iter:   7 12:47:08  -118.379909c -4.86  -3.23
iter:   8 12:48:15  -118.378530c -4.66  -3.33
iter:   9 12:49:25  -118.377483c -5.08  -3.44
iter:  10 12:50:23  -118.377330c -5.67  -3.62
iter:  11 12:51:21  -118.377024c -5.82  -3.67
iter:  12 12:52:19  -118.377091c -5.60  -3.82
iter:  13 12:53:16  -118.377092c -6.15  -3.91
iter:  14 12:54:14  -118.377003c -6.38  -4.04c
iter:  15 12:55:11  -118.376958c -6.34  -4.06c
iter:  16 12:56:08  -118.376826c -6.75  -4.18c
iter:  17 12:57:05  -118.376807c -6.80  -4.25c
iter:  18 12:58:00  -118.376742c -6.92  -4.28c
iter:  19 12:58:57  -118.376717c -7.27  -4.44c
iter:  20 12:59:51  -118.376745c -7.44c -4.56c

Converged after 20 iterations.

Dipole moment: (-4.208500, -2.419664, 0.212300) |e|*Ang

Energy contributions relative to reference atoms: (reference = -8661686.411014)

Kinetic:       -203.585748
Potential:      +26.991953
External:        +0.000000
XC:             +62.405089
Entropy (-ST):   -2.333121
Local:           -3.021479
--------------------------
Free energy:   -119.543305
Extrapolated:  -118.376745

Showing only first 2 kpts
 Kpt  Band  Eigenvalues  Occupancy
  0   306     -0.29250    1.27823
  0   307     -0.27128    1.17779
  0   308     -0.25617    1.10378
  0   309     -0.24473    1.04689

  1   306     -0.27072    1.17507
  1   307     -0.24568    1.05166
  1   308     -0.23972    1.02190
  1   309     -0.19820    0.81641


Fermi level: -0.23534

No gap

Forces in eV/Ang:
  0 Au    0.00151   -0.00325   -0.01953
  1 Pd   -0.00242   -0.00207   -0.01589
  2 Pd    0.02025   -0.02092    0.02163
  3 Pd   -0.01722   -0.01054   -0.01062
  4 Pd   -0.00630   -0.01105    0.07239
  5 Pd   -0.00935    0.01140    0.00178
  6 Pd   -0.01254   -0.00950    0.01110
  7 Pd    0.02102   -0.00114   -0.05630
  8 Pd   -0.05724   -0.00185    0.02081
  9 Pd   -0.02628   -0.00703   -0.04441
 10 Pd    0.00072    0.00232   -0.01054
 11 Au   -0.00178    0.00202   -0.02051
 12 Pd    0.01045    0.01487   -0.00792
 13 Pd    0.01485    0.02090   -0.00671
 14 Pd    0.02520    0.01761   -0.02939
 15 Au   -0.01482   -0.02471    0.03081
 16 Pd   -0.02276    0.00816    0.00166
 17 Pd   -0.01836    0.01032    0.05224
 18 Au    0.00454    0.00004    0.01564
 19 Pd   -0.02641   -0.00848   -0.04008
 20 Pd    0.05051    0.01557    0.01449
 21 Pd    0.00405   -0.00030   -0.00123
 22 Pd   -0.00089   -0.00542   -0.00228
 23 Pd   -0.01138    0.01154    0.02287
 24 Pd    0.01489   -0.02007    0.03583
 25 Pd    0.02143   -0.00661   -0.03171
 26 Au   -0.00177   -0.02463    0.03415
 27 Pd   -0.00230   -0.03991   -0.01169
 28 Au   -0.00675   -0.01896    0.00130
 29 Au    0.04809   -0.00240    0.03763
 30 Pd   -0.02029   -0.08358    0.03708
 31 Au   -0.00095    0.00492   -0.02840
 32 Pd   -0.00103    0.00569   -0.00697
 33 Pd   -0.00304   -0.01101   -0.00965
 34 Pd   -0.01844    0.02266    0.02328
 35 Pd   -0.02383    0.01207    0.05822
 36 Pd    0.00270    0.02152    0.00250
 37 Pd    0.00899    0.03856   -0.01860
 38 Pd    0.00271    0.01549   -0.07723
 39 Pd    0.06952    0.00008   -0.07232
 40 Pd   -0.02151    0.08091    0.03259

System changes: positions 

Initializing position-dependent things.

Density initialized from wave functions
      .-------------------.  
     /|                   |  
    / |                   |  
   /  |                   |  
  /   |                   |  
 *    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |         Pd        |  
 |    |Pd        Pd       |  
 |    | Au Au        Pd   |  
 |    |     Pd            |  
 |   Pd        Pd     Pd  |  
 |    Pd Pd     PdAu      |  
 |    |Pd Pd     Au Pd    |  
 |    | Pd PdPd      Pd   |  
 |   Au     Pd Pd     Pd  |  
 |    |                   |  
 |    PdPd      PdPd      |  
 |    |Pd Pd     Au Pd    |  
 |    |    PdPd      Au   |  
 |   Pd        Pd         |  
 |    |                   |  
 |    | Au         Pd     |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    .-------------------.  
 |   /                   /   
 |  /                   /    
 | /                   /     
 |/                   /      
 *-------------------*       

Positions:
   0 Au     2.969453    0.019505    9.917285    ( 0.0000,  0.0000,  0.0000)
   1 Pd     4.993656    2.005292   10.012678    ( 0.0000,  0.0000,  0.0000)
   2 Pd     3.003027    2.012646   12.004181    ( 0.0000,  0.0000,  0.0000)
   3 Pd     4.995158    0.016985   11.992550    ( 0.0000,  0.0000,  0.0000)
   4 Pd     3.002828    0.002009   13.985213    ( 0.0000,  0.0000,  0.0000)
   5 Pd     4.995614    2.012032   14.019409    ( 0.0000,  0.0000,  0.0000)
   6 Pd     3.010788    2.013899   16.034063    ( 0.0000,  0.0000,  0.0000)
   7 Pd     4.985323    0.011826   16.040820    ( 0.0000,  0.0000,  0.0000)
   8 Pd     3.016148    0.000389   18.008223    ( 0.0000,  0.0000,  0.0000)
   9 Pd     4.997853    1.971159   18.034418    ( 0.0000,  0.0000,  0.0000)
  10 Pd     2.970336    3.993170   10.044600    ( 0.0000,  0.0000,  0.0000)
  11 Au     4.993938    6.016279    9.938671    ( 0.0000,  0.0000,  0.0000)
  12 Pd     2.970612    6.013626   11.998436    ( 0.0000,  0.0000,  0.0000)
  13 Pd     4.991803    3.995186   11.991449    ( 0.0000,  0.0000,  0.0000)
  14 Pd     2.996410    4.012199   14.032404    ( 0.0000,  0.0000,  0.0000)
  15 Au     4.994447    6.012093   14.009870    ( 0.0000,  0.0000,  0.0000)
  16 Pd     2.990086    6.004429   16.034928    ( 0.0000,  0.0000,  0.0000)
  17 Pd     4.995303    3.997355   16.049024    ( 0.0000,  0.0000,  0.0000)
  18 Au     2.910223    4.010904   18.128078    ( 0.0000,  0.0000,  0.0000)
  19 Pd     4.997053    6.045423   18.011105    ( 0.0000,  0.0000,  0.0000)
  20 Pd     5.055230    4.013400   19.789188    ( 0.0000,  0.0000,  0.0000)
  21 Pd     7.014623    0.018248   10.045574    ( 0.0000,  0.0000,  0.0000)
  22 Pd     0.982540    2.005569   10.039276    ( 0.0000,  0.0000,  0.0000)
  23 Pd     6.985832    2.000081   12.004526    ( 0.0000,  0.0000,  0.0000)
  24 Pd     0.977090   -0.011727   12.005344    ( 0.0000,  0.0000,  0.0000)
  25 Pd     6.982871    0.002441   14.023367    ( 0.0000,  0.0000,  0.0000)
  26 Au     0.983602    2.021020   14.003383    ( 0.0000,  0.0000,  0.0000)
  27 Pd     6.978344    2.019117   16.026529    ( 0.0000,  0.0000,  0.0000)
  28 Au     0.992362   -0.014821   16.033990    ( 0.0000,  0.0000,  0.0000)
  29 Au     6.984660    0.000328   18.140456    ( 0.0000,  0.0000,  0.0000)
  30 Pd     0.958122    2.005405   18.010745    ( 0.0000,  0.0000,  0.0000)
  31 Au     7.018717    3.991587    9.915833    ( 0.0000,  0.0000,  0.0000)
  32 Pd     0.982995    6.015874   10.013789    ( 0.0000,  0.0000,  0.0000)
  33 Pd     7.019266    6.020800   11.998973    ( 0.0000,  0.0000,  0.0000)
  34 Pd     0.988054    4.023334   11.997649    ( 0.0000,  0.0000,  0.0000)
  35 Pd     6.995182    4.012110   13.993045    ( 0.0000,  0.0000,  0.0000)
  36 Pd     0.983549    5.997689   14.008797    ( 0.0000,  0.0000,  0.0000)
  37 Pd     7.000608    5.999006   16.028336    ( 0.0000,  0.0000,  0.0000)
  38 Pd     0.973211    4.022448   16.043219    ( 0.0000,  0.0000,  0.0000)
  39 Pd     7.041145    4.011004   18.007215    ( 0.0000,  0.0000,  0.0000)
  40 Pd     0.957064    6.018753   18.038119    ( 0.0000,  0.0000,  0.0000)

Unit cell:
           periodic     x           y           z      points  spacing
  1. axis:    yes    8.021790    0.000000    0.000000    40     0.2005
  2. axis:    yes    0.000000    8.021790    0.000000    40     0.2005
  3. axis:    no     0.000000    0.000000   30.027237   140     0.2145

  Lengths:   8.021790   8.021790  30.027237
  Angles:   90.000000  90.000000  90.000000

Effective grid spacing dv^(1/3) = 0.2051

     iter     time        total  log10-change:
                         energy  eigst   dens
iter:   1 13:01:15  -118.493484  -2.85
iter:   2 13:02:18  -119.894691  -2.99  -2.70
iter:   3 13:03:15  -118.402994  -3.31  -2.13
iter:   4 13:04:11  -118.392193  -4.42  -3.07
iter:   5 13:05:08  -118.392471c -4.68  -3.31
iter:   6 13:06:05  -118.389032c -4.98  -3.31
iter:   7 13:07:02  -118.388548c -5.14  -3.54
iter:   8 13:07:58  -118.388353c -5.48  -3.69
iter:   9 13:08:55  -118.389226c -5.75  -3.79
iter:  10 13:09:51  -118.388052c -5.85  -3.63
iter:  11 13:10:48  -118.388015c -6.02  -3.95
iter:  12 13:11:45  -118.387991c -6.42  -4.09c
iter:  13 13:12:40  -118.387985c -6.77  -4.13c
iter:  14 13:13:35  -118.387941c -6.72  -4.25c
iter:  15 13:14:30  -118.387962c -6.64  -4.42c
iter:  16 13:15:25  -118.387898c -7.28  -4.43c
iter:  17 13:16:19  -118.387909c -7.50c -4.44c

Converged after 17 iterations.

Dipole moment: (-4.141362, -2.025930, 0.209322) |e|*Ang

Energy contributions relative to reference atoms: (reference = -8661686.411014)

Kinetic:       -204.417073
Potential:      +27.673753
External:        +0.000000
XC:             +62.543210
Entropy (-ST):   -2.329495
Local:           -3.023050
--------------------------
Free energy:   -119.552656
Extrapolated:  -118.387909

Showing only first 2 kpts
 Kpt  Band  Eigenvalues  Occupancy
  0   306     -0.29578    1.27556
  0   307     -0.27651    1.18441
  0   308     -0.26087    1.10791
  0   309     -0.24683    1.03812

  1   306     -0.27510    1.17757
  1   307     -0.24961    1.05199
  1   308     -0.24285    1.01824
  1   309     -0.20120    0.81222


Fermi level: -0.23921

No gap

Forces in eV/Ang:
  0 Au   -0.00350   -0.00065   -0.00122
  1 Pd    0.00088    0.00203   -0.00817
  2 Pd    0.00128    0.00120    0.01135
  3 Pd    0.00120   -0.00528    0.01596
  4 Pd    0.01413   -0.01153    0.03666
  5 Pd   -0.00586    0.00827    0.00262
  6 Pd   -0.01633   -0.00615    0.00825
  7 Pd    0.00288    0.00079    0.00008
  8 Pd   -0.02988   -0.00535    0.00644
  9 Pd    0.00122   -0.00469   -0.02362
 10 Pd   -0.00032    0.00110   -0.00511
 11 Au    0.00036    0.00188   -0.02736
 12 Pd   -0.00008    0.00218    0.00102
 13 Pd    0.00196    0.00114   -0.00724
 14 Pd    0.00052   -0.00438   -0.02654
 15 Au   -0.00138   -0.00149    0.01010
 16 Pd   -0.02768    0.00862    0.01180
 17 Pd    0.00080   -0.00374    0.01509
 18 Au   -0.00587   -0.00098   -0.00402
 19 Pd    0.00174    0.00891   -0.01889
 20 Pd    0.04388    0.00879    0.01200
 21 Pd    0.00406   -0.00037    0.00000
 22 Pd    0.00040   -0.00400    0.00785
 23 Pd   -0.00434    0.00220    0.00928
 24 Pd    0.00499   -0.00574    0.00443
 25 Pd   -0.01049   -0.01455   -0.05232
 26 Au    0.00614    0.00906   -0.01128
 27 Pd   -0.00698   -0.01800    0.00101
 28 Au   -0.00255   -0.00996   -0.00292
 29 Au   -0.01847   -0.00441    0.01363
 30 Pd    0.00493   -0.02563    0.02176
 31 Au    0.00056   -0.00028   -0.00702
 32 Pd    0.00043    0.00590   -0.00547
 33 Pd   -0.00478    0.00411    0.00556
 34 Pd    0.00210   -0.00078    0.02051
 35 Pd   -0.01267    0.00113    0.04440
 36 Pd    0.00332    0.00578   -0.02019
 37 Pd    0.00444    0.02119   -0.00039
 38 Pd    0.01852    0.00873   -0.00697
 39 Pd    0.03301   -0.00094   -0.04598
 40 Pd    0.00423    0.02258    0.01702

System changes: positions 

Initializing position-dependent things.

Density initialized from wave functions
      .-------------------.  
     /|                   |  
    / |                   |  
   /  |                   |  
  /   |                   |  
 *    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |       PdPd     Au |  
 |    |Pd        Pd       |  
 |    | Au Au        Pd   |  
 |    |     Pd            |  
 |   Pd        Pd     Pd  |  
 |    Pd        Pd        |  
 |    |Pd Pd     Au Pd    |  
 |    | Pd PdPd      Pd   |  
 |   Au     Pd Pd     Pd  |  
 |    |                   |  
 |    PdPd      PdPd      |  
 |    |Pd Pd     Au Pd    |  
 |    |    PdPd      Au   |  
 |   Pd        Pd         |  
 |    |                   |  
 |    | Au         Pd     |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    |                   |  
 |    .-------------------.  
 |   /                   /   
 |  /                   /    
 | /                   /     
 |/                   /      
 *-------------------*       

Positions:
   0 Au     2.968358    0.019914    9.911689    ( 0.0000,  0.0000,  0.0000)
   1 Pd     4.993705    2.005561   10.010644    ( 0.0000,  0.0000,  0.0000)
   2 Pd     3.004159    2.011110   12.007040    ( 0.0000,  0.0000,  0.0000)
   3 Pd     4.993378    0.014452   11.992509    ( 0.0000,  0.0000,  0.0000)
   4 Pd     3.004684    0.000148   13.992424    ( 0.0000,  0.0000,  0.0000)
   5 Pd     4.994560    2.014064   14.020577    ( 0.0000,  0.0000,  0.0000)
   6 Pd     3.007614    2.014026   16.037244    ( 0.0000,  0.0000,  0.0000)
   7 Pd     4.987667    0.011569   16.039747    ( 0.0000,  0.0000,  0.0000)
   8 Pd     3.010593   -0.000469   18.009755    ( 0.0000,  0.0000,  0.0000)
   9 Pd     4.997039    1.966803   18.029061    ( 0.0000,  0.0000,  0.0000)
  10 Pd     2.969569    3.992639   10.045635    ( 0.0000,  0.0000,  0.0000)
  11 Au     4.993967    6.016576    9.931654    ( 0.0000,  0.0000,  0.0000)
  12 Pd     2.972386    6.015750   11.996661    ( 0.0000,  0.0000,  0.0000)
  13 Pd     4.994073    3.997580   11.988067    ( 0.0000,  0.0000,  0.0000)
  14 Pd     2.997817    4.012239   14.029221    ( 0.0000,  0.0000,  0.0000)
  15 Au     4.993832    6.010889   14.012139    ( 0.0000,  0.0000,  0.0000)
  16 Pd     2.985631    6.004353   16.038383    ( 0.0000,  0.0000,  0.0000)
  17 Pd     4.993385    3.997275   16.056881    ( 0.0000,  0.0000,  0.0000)
  18 Au     2.902396    4.010741   18.132369    ( 0.0000,  0.0000,  0.0000)
  19 Pd     4.996257    6.049424   18.004195    ( 0.0000,  0.0000,  0.0000)
  20 Pd     5.069272    4.015551   19.779131    ( 0.0000,  0.0000,  0.0000)
  21 Pd     7.016024    0.018995   10.047859    ( 0.0000,  0.0000,  0.0000)
  22 Pd     0.982549    2.004752   10.042868    ( 0.0000,  0.0000,  0.0000)
  23 Pd     6.984638    2.002108   12.007104    ( 0.0000,  0.0000,  0.0000)
  24 Pd     0.979562   -0.013161   12.008235    ( 0.0000,  0.0000,  0.0000)
  25 Pd     6.981864    0.000227   14.016745    ( 0.0000,  0.0000,  0.0000)
  26 Au     0.984624    2.021330   14.004213    ( 0.0000,  0.0000,  0.0000)
  27 Pd     6.977527    2.013676   16.027063    ( 0.0000,  0.0000,  0.0000)
  28 Au     0.990544   -0.016663   16.034438    ( 0.0000,  0.0000,  0.0000)
  29 Au     6.984069   -0.000409   18.150669    ( 0.0000,  0.0000,  0.0000)
  30 Pd     0.956064    1.997296   18.014284    ( 0.0000,  0.0000,  0.0000)
  31 Au     7.019338    3.991120    9.908935    ( 0.0000,  0.0000,  0.0000)
  32 Pd     0.983035    6.016992   10.012604    ( 0.0000,  0.0000,  0.0000)
  33 Pd     7.017158    6.019761   11.997811    ( 0.0000,  0.0000,  0.0000)
  34 Pd     0.986518    4.023996   12.001379    ( 0.0000,  0.0000,  0.0000)
  35 Pd     6.992211    4.012722   14.000391    ( 0.0000,  0.0000,  0.0000)
  36 Pd     0.984294    5.998921   14.007090    ( 0.0000,  0.0000,  0.0000)
  37 Pd     7.001228    6.004600   16.028510    ( 0.0000,  0.0000,  0.0000)
  38 Pd     0.976508    4.023995   16.040460    ( 0.0000,  0.0000,  0.0000)
  39 Pd     7.053366    4.010845   17.995499    ( 0.0000,  0.0000,  0.0000)
  40 Pd     0.954793    6.026407   18.043720    ( 0.0000,  0.0000,  0.0000)

Unit cell:
           periodic     x           y           z      points  spacing
  1. axis:    yes    8.021790    0.000000    0.000000    40     0.2005
  2. axis:    yes    0.000000    8.021790    0.000000    40     0.2005
  3. axis:    no     0.000000    0.000000   30.027237   140     0.2145

  Lengths:   8.021790   8.021790  30.027237
  Angles:   90.000000  90.000000  90.000000

Effective grid spacing dv^(1/3) = 0.2051

     iter     time        total  log10-change:
                         energy  eigst   dens
iter:   1 13:17:40  -118.522554  -3.04
iter:   2 13:18:35  -121.133216  -2.78  -2.64
iter:   3 13:19:34  -118.402939  -3.16  -2.01
iter:   4 13:20:32  -118.402619  -4.02  -3.20
iter:   5 13:21:30  -118.394509c -4.90  -3.18
iter:   6 13:22:27  -118.393205c -5.12  -3.47
iter:   7 13:23:24  -118.392991c -5.32  -3.66
iter:   8 13:24:25  -118.392660c -5.72  -3.77
iter:   9 13:25:23  -118.392643c -6.00  -3.90
iter:  10 13:26:32  -118.392456c -6.10  -3.99
iter:  11 13:27:28  -118.392422c -6.31  -4.13c
iter:  12 13:28:24  -118.392431c -6.67  -4.24c
iter:  13 13:29:30  -118.392402c -7.02  -4.39c
iter:  14 13:30:32  -118.392447c -6.92  -4.39c
iter:  15 13:31:41  -118.392385c -7.20  -4.52c
iter:  16 13:32:51  -118.392401c -7.43c -4.70c

Converged after 16 iterations.

Dipole moment: (-4.073375, -1.539227, 0.206562) |e|*Ang

Energy contributions relative to reference atoms: (reference = -8661686.411014)

Kinetic:       -204.989653
Potential:      +28.145583
External:        +0.000000
XC:             +62.645215
Entropy (-ST):   -2.326691
Local:           -3.030202
--------------------------
Free energy:   -119.555747
Extrapolated:  -118.392401

Showing only first 2 kpts
 Kpt  Band  Eigenvalues  Occupancy
  0   306     -0.29844    1.27657
  0   307     -0.28025    1.19066
  0   308     -0.26375    1.11007
  0   309     -0.24746    1.02906

  1   306     -0.27742    1.17698
  1   307     -0.25183    1.05087
  1   308     -0.24425    1.01301
  1   309     -0.20277    0.80804


Fermi level: -0.24165

No gap

Forces in eV/Ang:
  0 Au    0.00216    0.00319    0.01665
  1 Pd   -0.00018   -0.00370    0.00775
  2 Pd    0.00512   -0.00020   -0.00428
  3 Pd   -0.00141    0.00949    0.00472
  4 Pd    0.00686    0.00214    0.00409
  5 Pd   -0.00533   -0.00022    0.00774
  6 Pd   -0.00292   -0.00598   -0.00392
  7 Pd   -0.01826    0.00413    0.00451
  8 Pd   -0.00619   -0.00172    0.00604
  9 Pd   -0.00326    0.01833    0.00651
 10 Pd   -0.00441    0.00061    0.00244
 11 Au    0.00073    0.00453   -0.01422
 12 Pd   -0.00132   -0.00624    0.00188
 13 Pd   -0.00305   -0.00520    0.00230
 14 Pd    0.00147    0.00206   -0.00051
 15 Au   -0.00799   -0.00903    0.01270
 16 Pd   -0.00391    0.00036   -0.00263
 17 Pd   -0.00355   -0.00144   -0.01104
 18 Au    0.03045   -0.00134    0.00947
 19 Pd   -0.00228   -0.01197    0.01197
 20 Pd    0.01900    0.00355   -0.01547
 21 Pd   -0.00047    0.00071    0.00483
 22 Pd    0.00026    0.00158    0.01338
 23 Pd   -0.00353    0.00161   -0.00274
 24 Pd    0.00347    0.00342   -0.00811
 25 Pd   -0.00244    0.00428   -0.01955
 26 Au   -0.00542    0.00015   -0.00880
 27 Pd    0.00892   -0.00676   -0.01137
 28 Au   -0.01437    0.00683   -0.01721
 29 Au   -0.02569   -0.00120   -0.00047
 30 Pd    0.01124   -0.00035    0.01350
 31 Au    0.00765   -0.00031    0.01551
 32 Pd   -0.00190   -0.00234    0.00696
 33 Pd    0.00319   -0.00615    0.00112
 34 Pd   -0.00137    0.00288   -0.00320
 35 Pd    0.00378   -0.00035    0.01909
 36 Pd   -0.00141   -0.00500   -0.01281
 37 Pd    0.01018    0.00146   -0.00491
 38 Pd    0.00872    0.00196    0.00128
 39 Pd   -0.00630   -0.00012   -0.00870
 40 Pd    0.01098   -0.00392    0.01045

Timing:                                      incl.     excl.
-------------------------------------------------------------------
Density initialized from wave functions:    20.175    20.175   0.2% |
 Symmetrize density:                         0.000     0.000   0.0% |
Forces:                                    105.869   105.869   1.3% ||
Hamiltonian:                                13.564     0.072   0.0% |
 Atomic:                                     2.353     1.231   0.0% |
  XC Correction:                             1.122     1.122   0.0% |
 Calculate atomic Hamiltonians:              7.156     7.156   0.1% |
 Communicate:                                0.001     0.001   0.0% |
 Initialize Hamiltonian:                     0.000     0.000   0.0% |
 Poisson:                                    0.057     0.057   0.0% |
 XC 3D grid:                                 3.925     3.925   0.0% |
LCAO initialization:                        81.267     0.411   0.0% |
 LCAO eigensolver:                           7.040     0.001   0.0% |
  Calculate projections:                     0.056     0.056   0.0% |
  DenseAtomicCorrection:                     0.053     0.053   0.0% |
  Distribute overlap matrix:                 0.005     0.005   0.0% |
  Orbital Layouts:                           0.324     0.324   0.0% |
  Potential matrix:                          6.572     6.572   0.1% |
  Sum over cells:                            0.030     0.030   0.0% |
 LCAO to grid:                              71.857    71.857   0.9% |
 Set positions (LCAO WFS):                   1.959     0.426   0.0% |
  Basic WFS set positions:                   0.003     0.003   0.0% |
  Basis functions set positions:             0.000     0.000   0.0% |
  P tci:                                     1.049     1.049   0.0% |
  ST tci:                                    0.370     0.370   0.0% |
  mktci:                                     0.112     0.112   0.0% |
PWDescriptor:                                0.574     0.574   0.0% |
Redistribute:                                0.054     0.054   0.0% |
SCF-cycle:                                7931.861   536.866   6.5% |--|
 Davidson:                                6554.992  1536.540  18.6% |------|
  Apply H:                                 511.625   500.738   6.1% |-|
   HMM T:                                   10.887    10.887   0.1% |
  Subspace diag:                          1072.615     0.036   0.0% |
   calc_h_matrix:                          720.342   207.284   2.5% ||
    Apply H:                               513.058   501.953   6.1% |-|
     HMM T:                                 11.105    11.105   0.1% |
   diagonalize:                             31.640    31.640   0.4% |
   rotate_psi:                             320.598   320.598   3.9% |-|
  calc. matrices:                         2326.860  1326.275  16.0% |-----|
   Apply H:                               1000.585   979.295  11.8% |----|
    HMM T:                                  21.289    21.289   0.3% |
  diagonalize:                             440.883   440.883   5.3% |-|
  rotate_psi:                              666.468   666.468   8.1% |--|
 Density:                                  484.919     0.007   0.0% |
  Atomic density matrices:                   1.988     1.988   0.0% |
  Mix:                                     192.568   192.568   2.3% ||
  Multipole moments:                         0.142     0.142   0.0% |
  Pseudo density:                          290.214   290.208   3.5% ||
   Symmetrize density:                       0.006     0.006   0.0% |
 Hamiltonian:                              306.610     1.581   0.0% |
  Atomic:                                   73.689    49.230   0.6% |
   XC Correction:                           24.459    24.459   0.3% |
  Calculate atomic Hamiltonians:           151.399   151.399   1.8% ||
  Communicate:                               0.415     0.415   0.0% |
  Poisson:                                   1.213     1.213   0.0% |
  XC 3D grid:                               78.313    78.313   0.9% |
 Orthonormalize:                            48.474     0.003   0.0% |
  calc_s_matrix:                             4.613     4.613   0.1% |
  inverse-cholesky:                         21.701    21.701   0.3% |
  projections:                              14.304    14.304   0.2% |
  rotate_psi_s:                              7.854     7.854   0.1% |
Set symmetry:                                0.003     0.003   0.0% |
Other:                                     119.983   119.983   1.5% ||
-------------------------------------------------------------------
Total:                                              8273.350 100.0%

Memory usage: 1.01 GiB
Date: Mon Mar 27 13:33:12 2023
