==============================================================================
Program HPRO
Author: Xiaoxun Gong (xiaoxun.gong@gmail.com)
==============================================================================

Structure information:
Primitive lattice vectors (angstrom):
a = (   0.0000000    3.5670000    3.5670000)
b = (   3.5670000    0.0000000    3.5670000)
c = (   3.5670000    3.5670000    0.0000000)
Atomic species and numbers in unit cell: C: 16.

Atomic orbital basis:
Format: siesta
Element C:
Orbital 1: l = 0, cutoff =  4.493 a.u., norm =  1.000
Orbital 2: l = 0, cutoff =  4.502 a.u., norm =  1.000
Orbital 3: l = 1, cutoff =  5.468 a.u., norm =  1.000
Orbital 4: l = 1, cutoff =  5.479 a.u., norm =  1.000
Orbital 5: l = 2, cutoff =  5.446 a.u., norm =  1.000

Real space grid dimensions: (   48    48    48)

Pseudopotential projectors:
Format: qe
Element C:
Orbital 1: l = 0, cutoff =  1.310 a.u., norm =  1.000
Orbital 2: l = 0, cutoff =  1.310 a.u., norm =  1.000
Orbital 3: l = 1, cutoff =  1.310 a.u., norm =  1.000
Orbital 4: l = 1, cutoff =  1.310 a.u., norm =  1.000

IO done, total wall time = 0:00:00

===============================================
Reconstructing PW Hamiltonian to AOs in real space
===============================================

Calculating overlap

Writing overlap matrices to disk

Constructing Hamiltonian operator with 1196 blocks
 10%|████                                    | 120/1196 [00:13<02:01,  8.88it/s]
 20%|████████                                | 240/1196 [00:34<02:20,  6.79it/s]
 30%|████████████                            | 360/1196 [00:49<01:57,  7.12it/s]
 40%|████████████████                        | 480/1196 [01:06<01:39,  7.20it/s]
 50%|████████████████████                    | 600/1196 [01:23<01:23,  7.13it/s]
 60%|████████████████████████                | 720/1196 [01:36<01:02,  7.66it/s]
 70%|████████████████████████████            | 840/1196 [01:55<00:49,  7.21it/s]
 80%|████████████████████████████████        | 960/1196 [02:11<00:32,  7.30it/s]
 90%|████████████████████████████████████    | 1080/1196 [02:26<00:15,  7.54it/s]
100%|████████████████████████████████████████| 1196/1196 [02:37<00:00,  7.57it/s]
Done, elapsed time: 157.9s.

Writing Hamiltonian matrices to disk

Job done, total wall time = 0:02:41