| Name | Date | Size | #Lines | LOC | ||
|---|---|---|---|---|---|---|
| .. | 20-Aug-2021 | - | ||||
| dynmat/ | H | 20-Aug-2021 | - | 322 | 207 | |
| kpgen/ | H | 20-Aug-2021 | - | 488 | 361 | |
| qbdriver/ | H | 20-Aug-2021 | - | 17,217 | 16,964 | |
| upf2qso/ | H | 20-Aug-2021 | - | 16,083 | 15,471 | |
| vext/ | H | 20-Aug-2021 | - | 134 | 102 | |
| cell.plt | H A D | 20-Aug-2021 | 1.3 KiB | 32 | 28 | |
| econst.plt | H A D | 20-Aug-2021 | 272 | 13 | 11 | |
| econst_cmp.plt | H A D | 20-Aug-2021 | 155 | 10 | 8 | |
| econste.plt | H A D | 20-Aug-2021 | 162 | 10 | 8 | |
| econste_cmp.plt | H A D | 20-Aug-2021 | 343 | 14 | 9 | |
| econste_cp.plt | H A D | 20-Aug-2021 | 198 | 10 | 8 | |
| egap.sh | H A D | 20-Aug-2021 | 589 | 20 | 11 | |
| eigsum.plt | H A D | 20-Aug-2021 | 139 | 10 | 8 | |
| enthalpy.plt | H A D | 20-Aug-2021 | 137 | 10 | 8 | |
| etotal.plt | H A D | 20-Aug-2021 | 135 | 10 | 8 | |
| etotal_cmp.plt | H A D | 20-Aug-2021 | 163 | 10 | 8 | |
| etotal_int.plt | H A D | 20-Aug-2021 | 144 | 11 | 9 | |
| etotal_int_cmp.plt | H A D | 20-Aug-2021 | 155 | 10 | 8 | |
| force.plt | H A D | 20-Aug-2021 | 142 | 10 | 8 | |
| get_atomset.sh | H A D | 20-Aug-2021 | 187 | 9 | 3 | |
| qbox_angle.py | H A D | 20-Aug-2021 | 2.5 KiB | 94 | 75 | |
| qbox_distance.py | H A D | 20-Aug-2021 | 1.8 KiB | 71 | 56 | |
| qbox_dos.py | H A D | 20-Aug-2021 | 2.7 KiB | 102 | 77 | |
| qbox_eig.py | H A D | 20-Aug-2021 | 2.1 KiB | 92 | 72 | |
| qbox_force.py | H A D | 20-Aug-2021 | 1.2 KiB | 48 | 36 | |
| qbox_maxforce.py | H A D | 20-Aug-2021 | 2.6 KiB | 110 | 88 | |
| qbox_move_subsample.py | H A D | 20-Aug-2021 | 2.8 KiB | 104 | 81 | |
| qbox_move_to.py | H A D | 20-Aug-2021 | 3.1 KiB | 116 | 91 | |
| qbox_msd.py | H A D | 20-Aug-2021 | 1.8 KiB | 69 | 52 | |
| qbox_position.py | H A D | 20-Aug-2021 | 1.1 KiB | 48 | 36 | |
| qbox_reduce.sh | H A D | 20-Aug-2021 | 255 | 12 | 8 | |
| qbox_repair_h2o.py | H A D | 20-Aug-2021 | 2.2 KiB | 84 | 67 | |
| qbox_replicate.sh | H A D | 20-Aug-2021 | 1.2 KiB | 32 | 26 | |
| qbox_species_temp.sh | H A D | 20-Aug-2021 | 1 KiB | 32 | 17 | |
| qbox_torsion.py | H A D | 20-Aug-2021 | 3.6 KiB | 136 | 107 | |
| qbox_translate.sh | H A D | 20-Aug-2021 | 498 | 18 | 13 | |
| qbox_vavg.py | H A D | 20-Aug-2021 | 2.1 KiB | 86 | 46 | |
| qbox_velocity.py | H A D | 20-Aug-2021 | 1.2 KiB | 48 | 36 | |
| qbox_xyz.py | H A D | 20-Aug-2021 | 3.3 KiB | 125 | 97 | |
| qbox_xyz.sh | H A D | 20-Aug-2021 | 1.4 KiB | 40 | 32 | |
| qso.py | H A D | 20-Aug-2021 | 4.8 KiB | 154 | 133 | |
| qso2qbox.py | H A D | 20-Aug-2021 | 1.9 KiB | 71 | 49 | |
| qso2qe.py | H A D | 20-Aug-2021 | 2 KiB | 84 | 63 | |
| qso_plot_species.py | H A D | 20-Aug-2021 | 4.6 KiB | 171 | 145 | |
| sample_to_move.sh | H A D | 20-Aug-2021 | 806 | 29 | 22 | |
| sample_to_sys.sh | H A D | 20-Aug-2021 | 1.4 KiB | 42 | 36 | |
| sigma.plt | H A D | 20-Aug-2021 | 300 | 12 | 10 | |
| temp_ion.plt | H A D | 20-Aug-2021 | 273 | 14 | 11 | |
| volume.plt | H A D | 20-Aug-2021 | 154 | 11 | 9 | |
| xyz2qbox.py | H A D | 20-Aug-2021 | 466 | 19 | 15 |