Using integrator: PointIntegrator
FrequencyGridDescriptor(from 0.000+0.000j to 0.000+27.211j eV, 2 points)
Nonperiodic BCs:  [False False False]
Using integrator: PointIntegrator
FrequencyGridDescriptor(from 0.000+0.000j to 0.000+27.211j eV, 2 points)
Nonperiodic BCs:  [False False False]
  ___  _ _ _
 |   || | | |
 | | || | | |
 |__ ||_____|
 |___|

BZ k-points: Symmetries present (total): 24

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

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

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

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

8 k-points: 2 x 2 x 2 Monkhorst-Pack grid + [1/4,1/4,1/4]
3 k-points in the irreducible part of the Brillouin zone
       k-points in crystal coordinates                weights
   0:     0.00000000    0.00000000    0.00000000          1/8
   1:     0.50000000    0.50000000    0.00000000          3/8
   2:     0.50000000    0.50000000    0.50000000          4/8

Distributing spins, k-points and bands (1 x 1 x 3) over 1 process
Number of blocks: 1

Quasi particle states:
k-points (IBZ indices): [0]
Band range: (3, 6)

Computational parameters:
Plane wave cut-off: 50 eV
Number of bands: 16
Coulomb cutoff: None
Broadening: 0.1 eV

fxc modes: GW
Kernel: RPA
Using Godby-Needs plasmon-pole approximation:
  Fitting energy: i*E0, E0 = 1.000 Hartree
Summing all q:

Calculating screened Coulomb potential
No Coulomb truncation
FrequencyGridDescriptor(from 0.000+0.000j to 0.000+27.211j eV, 2 points)
  memory estimate for chi0: local=0.07 MB, global=0.07 MB
Removing empty qpoint cache files...

Wed Oct 28 00:07:34 2026
Calculating chi0 body with:
    Ground state adapter containing:
    Number of spins: 1
    Number of kpoints: 8
    Number of irreducible kpoints: 3
    Number of completely occupied states: 4
    Number of partially occupied states: 4
    Occupied states memory: 0.20599365234375 M / cpu

    Linear response parametrization:
    q_c: [0.0, 0.0, 0.0]
    Number of frequency points: 2
    Planewave cutoff: 50.0
    Number of bands: 16
    Number of planewaves: 27
    Broadening (eta): 1e-06
    comm.size: 1
    kncomm.size: 1
    blockcomm.size: 1

    Memory estimate of potentially large arrays:
        chi0_wGG: 0.022247314453125 M / cpu
        Memory usage before allocation: 127.67578125 M / cpu
Integrating chi0 body.

Symmetries of q_c:
    Direct symmetries (Uq -> q): 24
    Indirect symmetries (TUq -> q): 24
In total 48 allowed symmetries.

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

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

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

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

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

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

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

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

3 groups of equivalent kpoints. 62.5% reduction.

Integral kind: response function
0.026847124099731445s |----------------------------------------| Time: 0.035s
Integrating chi0 head and wings.

Symmetries of q_c:
    Direct symmetries (Uq -> q): 24
    Indirect symmetries (TUq -> q): 24
In total 48 allowed symmetries.

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

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

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

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

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

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

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

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

3 groups of equivalent kpoints. 62.5% reduction.

Integral kind: response function wings
0.14644932746887207s |----------------------------------------| Time: 0.090s

Wed Oct 28 00:07:35 2026
Calculating chi0 body with:
    Ground state adapter containing:
    Number of spins: 1
    Number of kpoints: 8
    Number of irreducible kpoints: 3
    Number of completely occupied states: 4
    Number of partially occupied states: 4
    Occupied states memory: 0.20599365234375 M / cpu

    Linear response parametrization:
    q_c: [0.5, 0.5, 0.0]
    Number of frequency points: 2
    Planewave cutoff: 50.0
    Number of bands: 16
    Number of planewaves: 32
    Broadening (eta): 1e-06
    comm.size: 1
    kncomm.size: 1
    blockcomm.size: 1

    Memory estimate of potentially large arrays:
        chi0_wGG: 0.03125 M / cpu
        Memory usage before allocation: 166.62109375 M / cpu
Integrating chi0 body.

Symmetries of q_c:
    Direct symmetries (Uq -> q): 8
    Indirect symmetries (TUq -> q): 8
In total 16 allowed symmetries.

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

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

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

4 groups of equivalent kpoints. 50.0% reduction.

Integral kind: response function
0.026935577392578125s |----------------------------------------| Time: 0.033s
2.390749454498291s |--------------------------
Wed Oct 28 00:07:35 2026
Calculating chi0 body with:
    Ground state adapter containing:
    Number of spins: 1
    Number of kpoints: 8
    Number of irreducible kpoints: 3
    Number of completely occupied states: 4
    Number of partially occupied states: 4
    Occupied states memory: 0.20599365234375 M / cpu

    Linear response parametrization:
    q_c: [0.5, 0.5, 0.5]
    Number of frequency points: 2
    Planewave cutoff: 50.0
    Number of bands: 16
    Number of planewaves: 34
    Broadening (eta): 1e-06
    comm.size: 1
    kncomm.size: 1
    blockcomm.size: 1

    Memory estimate of potentially large arrays:
        chi0_wGG: 0.0352783203125 M / cpu
        Memory usage before allocation: 167.35546875 M / cpu
Integrating chi0 body.

Symmetries of q_c:
    Direct symmetries (Uq -> q): 6
    Indirect symmetries (TUq -> q): 6
In total 12 allowed symmetries.

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

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

4 groups of equivalent kpoints. 50.0% reduction.

Integral kind: response function
0.0265045166015625s |----------------------------------------| Time: 0.033s
--------------| Time: 0.968s

Results:
f:      Occupation numbers
eps:     KS-eigenvalues [eV]
vxc:     KS vxc [eV]
exx:     Exact exchange [eV]
sigma:   Self-energies [eV]
dsigma:  Self-energy derivatives
Z:       Renormalization factors
qp:      QP-energies [eV]

k-point 0 (0): (0.000, 0.000, 0.000)                GW
band       f     eps     vxc     exx   sigma  dsigma       Z      qp
                                                                   GW
   3   1.000   5.616 -13.367 -15.899   2.823  -0.247   0.802   5.849
   4   0.000   8.054 -11.419  -6.494  -3.596  -0.270   0.787   9.100
   5   0.000   8.054 -11.419  -6.494  -3.600  -0.270   0.787   9.097
Timing:                                 incl.     excl.
--------------------------------------------------------------
G0W0:                                   1.638     0.019   0.8% |
 Get a k-point:                         0.042     0.001   0.0% |
  Load projections:                     0.003     0.003   0.1% |
  load wfs:                             0.038     0.038   1.6% ||
 W:                                     0.843     0.003   0.1% |
  calculate_w:                          0.841     0.007   0.3% |
   Calculate CHI_0:                     0.782     0.540  22.8% |--------|
    Get eigenvalues:                    0.003     0.003   0.1% |
    Get kpoints:                        0.008     0.008   0.3% |
    Get matrix element:                 0.183     0.045   1.9% ||
     Get kpoint pair:                   0.075     0.002   0.1% |
      fft indices:                      0.002     0.002   0.1% |
      get k-points:                     0.071     0.000   0.0% |
       Get a k-point:                   0.071     0.003   0.1% |
        Load projections:               0.010     0.010   0.4% |
        load wfs:                       0.058     0.058   2.4% ||
     get_optical_pair_density_head:     0.019     0.001   0.1% |
      Optical limit:                    0.018     0.004   0.2% |
       Derivatives:                     0.014     0.014   0.6% |
     get_pair_density:                  0.044     0.001   0.0% |
      conj:                             0.001     0.001   0.0% |
      paw:                              0.043     0.004   0.2% |
       Calculate pair-densities:        0.039     0.009   0.4% |
        fft:                            0.027     0.027   1.1% |
        gemm:                           0.003     0.003   0.1% |
    symmetrize_wGG:                     0.046     0.046   2.0% ||
   Dyson eq.:                           0.052     0.052   2.2% ||
 calculate_vxc_and_exx:                 0.656     0.656  27.7% |----------|
 evaluate sigma:                        0.076     0.015   0.6% |
  Wmodel.get_HW:                        0.031     0.031   1.3% ||
  get_nmG:                              0.023     0.002   0.1% |
   Calculate pair-densities:            0.021     0.006   0.2% |
    fft:                                0.014     0.014   0.6% |
    gemm:                               0.001     0.001   0.0% |
  n_G @ S_GG @ n_G:                     0.008     0.008   0.3% |
Get a k-point:                          0.002     0.000   0.0% |
 Load projections:                      0.001     0.001   0.0% |
 load wfs:                              0.001     0.001   0.0% |
Other:                                  0.731     0.731  30.8% |-----------|
--------------------------------------------------------------
Total:                                            2.370 100.0%

Wed Oct 28 00:07:36 2026
