| Name | Last modified | Size | Description | |
|---|---|---|---|---|
| Parent Directory | - | |||
| CHG | 2007-06-06 15:41 | 0 | ||
| CHGCAR | 2007-06-01 07:55 | 0 | ||
| CONTCAR | 2007-06-16 02:17 | 12K | ||
| CONTCAR.failed | 2007-06-10 06:53 | 12K | ||
| CONTCAR.failed2 | 2007-06-10 14:44 | 12K | ||
| CONTCAR.k1.run1 | 2007-06-06 16:51 | 12K | ||
| CONTCAR.k1.run2 | 2007-06-06 17:52 | 12K | ||
| CONTCAR.k2.run1 | 2007-06-06 23:31 | 12K | ||
| CONTCAR.k2.run2 | 2007-06-07 13:06 | 12K | ||
| CONTCAR.k3.run1 | 2007-06-08 03:28 | 12K | ||
| CONTCAR.k3.run2 | 2007-06-08 12:40 | 12K | ||
| CONTCAR.k4.run1 | 2007-06-11 07:00 | 12K | ||
| CONTCAR.k4.run2 | 2007-06-11 19:06 | 12K | ||
| CONTCAR.k4.tet.failed | 2007-06-14 17:48 | 12K | ||
| CONTCAR.k5.Normal.failed | 2007-06-11 19:06 | 12K | ||
| CONTCAR.k5.VeryFast.failed | 2007-06-14 07:41 | 12K | ||
| CONTCAR.k5.fast.failed | 2007-06-13 22:38 | 12K | ||
| DEBUG | 2007-09-11 23:16 | 12 | ||
| DOSCAR | 2007-06-16 02:17 | 11K | ||
| DOSCAR.failed | 2007-06-08 18:07 | 167 | ||
| DOSCAR.failed2 | 2007-06-10 14:04 | 167 | ||
| DOSCAR.k1.run1 | 2007-06-06 16:51 | 11K | ||
| DOSCAR.k1.run2 | 2007-06-06 17:52 | 11K | ||
| DOSCAR.k2.run1 | 2007-06-06 23:31 | 11K | ||
| DOSCAR.k2.run2 | 2007-06-07 13:06 | 11K | ||
| DOSCAR.k3.run1 | 2007-06-08 03:28 | 11K | ||
| DOSCAR.k3.run2 | 2007-06-08 09:24 | 167 | ||
| DOSCAR.k4.run1 | 2007-06-10 14:50 | 167 | ||
| DOSCAR.k4.run2 | 2007-06-11 08:24 | 167 | ||
| DOSCAR.k4.tet.failed | 2007-06-14 17:48 | 11K | ||
| DOSCAR.k5.Normal.failed | 2007-06-12 23:22 | 167 | ||
| DOSCAR.k5.VeryFast.failed | 2007-06-14 07:41 | 11K | ||
| DOSCAR.k5.fast.failed | 2007-06-13 12:13 | 167 | ||
| EIGENVAL | 2007-06-16 02:17 | 129K | ||
| FLAGS | 2007-06-06 15:41 | 421 | ||
| IBZKPT | 2007-06-15 17:42 | 12K | ||
| IBZKPT.failed | 2007-06-08 18:06 | 2.4K | ||
| IBZKPT.failed2 | 2007-06-10 14:04 | 2.4K | ||
| IBZKPT.k1.run1 | 2007-06-06 15:43 | 132 | ||
| IBZKPT.k1.run2 | 2007-06-06 16:53 | 132 | ||
| IBZKPT.k2.run1 | 2007-06-06 18:06 | 357 | ||
| IBZKPT.k2.run2 | 2007-06-07 08:45 | 357 | ||
| IBZKPT.k3.run1 | 2007-06-07 13:35 | 1.1K | ||
| IBZKPT.k3.run2 | 2007-06-08 09:24 | 1.1K | ||
| IBZKPT.k4.run1 | 2007-06-10 14:50 | 2.4K | ||
| IBZKPT.k4.run2 | 2007-06-11 08:24 | 2.4K | ||
| IBZKPT.k4.tet.failed | 2007-06-14 11:34 | 12K | ||
| IBZKPT.k5.Normal.failed | 2007-06-12 23:22 | 4.7K | ||
| IBZKPT.k5.VeryFast.failed | 2007-06-13 22:41 | 4.7K | ||
| IBZKPT.k5.fast.failed | 2007-06-13 12:13 | 4.7K | ||
| INCAR | 2007-06-15 17:42 | 478 | ||
| INCAR.diffs | 2007-06-13 22:40 | 460 | ||
| INCAR.failed | 2007-06-06 15:41 | 478 | ||
| INCAR.failed2 | 2007-06-10 10:44 | 473 | ||
| INCAR.k1.run1 | 2007-06-06 15:41 | 478 | ||
| INCAR.k1.run2 | 2007-06-06 15:41 | 478 | ||
| INCAR.k2.run1 | 2007-06-06 15:41 | 478 | ||
| INCAR.k2.run2 | 2007-06-06 15:41 | 478 | ||
| INCAR.k3.run1 | 2007-06-06 15:41 | 478 | ||
| INCAR.k3.run2 | 2007-06-06 15:41 | 478 | ||
| INCAR.k4.run1 | 2007-06-10 14:50 | 469 | ||
| INCAR.k4.run2 | 2007-06-10 14:50 | 469 | ||
| INCAR.k4.tet.failed | 2007-06-14 09:03 | 430 | ||
| INCAR.k5.Normal.failed | 2007-06-12 23:22 | 473 | ||
| INCAR.k5.VeryFast.failed | 2007-06-13 22:40 | 438 | ||
| INCAR.k5.fast.failed | 2007-06-13 12:12 | 471 | ||
| INCAR.last | 2007-06-13 22:40 | 478 | ||
| KPOINTS | 2007-06-14 09:04 | 191 | ||
| KPOINTS.failed | 2007-06-08 15:55 | 191 | ||
| KPOINTS.failed2 | 2007-06-08 15:55 | 191 | ||
| KPOINTS.k1.run1 | 2007-06-06 15:41 | 187 | ||
| KPOINTS.k1.run2 | 2007-06-06 15:41 | 187 | ||
| KPOINTS.k2.run1 | 2007-06-06 18:06 | 190 | ||
| KPOINTS.k2.run2 | 2007-06-06 18:06 | 190 | ||
| KPOINTS.k3.run1 | 2007-06-07 13:35 | 192 | ||
| KPOINTS.k3.run2 | 2007-06-07 13:35 | 192 | ||
| KPOINTS.k4.run1 | 2007-06-08 15:55 | 191 | ||
| KPOINTS.k4.run2 | 2007-06-08 15:55 | 191 | ||
| KPOINTS.k4.tet.failed | 2007-06-14 09:04 | 191 | ||
| KPOINTS.k5.Normal.failed | 2007-06-12 07:52 | 194 | ||
| KPOINTS.k5.VeryFast.failed | 2007-06-12 07:52 | 194 | ||
| KPOINTS.k5.fast.failed | 2007-06-12 07:52 | 194 | ||
| OSZICAR | 2007-06-16 02:17 | 3.6K | ||
| OSZICAR.failed | 2007-06-10 10:42 | 29K | ||
| OSZICAR.failed2 | 2007-06-10 14:44 | 233 | ||
| OSZICAR.k1.run1 | 2007-06-06 16:51 | 9.1K | ||
| OSZICAR.k1.run2 | 2007-06-06 17:52 | 8.0K | ||
| OSZICAR.k2.run1 | 2007-06-06 23:31 | 7.8K | ||
| OSZICAR.k2.run2 | 2007-06-07 13:06 | 6.6K | ||
| OSZICAR.k3.run1 | 2007-06-08 03:28 | 6.3K | ||
| OSZICAR.k3.run2 | 2007-06-08 12:40 | 4.2K | ||
| OSZICAR.k4.run1 | 2007-06-11 07:00 | 2.3K | ||
| OSZICAR.k4.run2 | 2007-06-11 19:06 | 2.2K | ||
| OSZICAR.k4.tet.failed | 2007-06-14 17:48 | 1.0K | ||
| OSZICAR.k5.Normal.failed | 2007-06-13 03:32 | 784 | ||
| OSZICAR.k5.VeryFast.failed | 2007-06-14 07:41 | 2.6K | ||
| OSZICAR.k5.fast.failed | 2007-06-13 22:38 | 3.3K | ||
| OUTCAR | 2007-06-16 02:17 | 380K | ||
| OUTCAR.failed | 2007-06-10 10:42 | 2.4M | ||
| OUTCAR.failed2 | 2007-06-10 14:44 | 66K | ||
| OUTCAR.k1.run1 | 2007-06-06 16:51 | 567K | ||
| OUTCAR.k1.run2 | 2007-06-06 17:52 | 545K | ||
| OUTCAR.k2.run1 | 2007-06-06 23:31 | 757K | ||
| OUTCAR.k2.run2 | 2007-06-07 13:06 | 734K | ||
| OUTCAR.k3.run1 | 2007-06-08 03:28 | 1.4M | ||
| OUTCAR.k3.run2 | 2007-06-08 12:40 | 1.0M | ||
| OUTCAR.k4.run1 | 2007-06-11 07:00 | 858K | ||
| OUTCAR.k4.run2 | 2007-06-11 19:06 | 856K | ||
| OUTCAR.k4.tet.failed | 2007-06-14 17:48 | 82K | ||
| OUTCAR.k5.Normal.failed | 2007-06-13 03:47 | 57K | ||
| OUTCAR.k5.VeryFast.failed | 2007-06-14 07:41 | 121K | ||
| OUTCAR.k5.fast.failed | 2007-06-13 22:38 | 135K | ||
| PCDAT | 2007-06-16 02:17 | 2.3K | ||
| PI24259 | 2007-06-12 23:02 | 58 | ||
| POSCAR | 2007-06-14 17:48 | 12K | ||
| POSCAR.failed | 2007-06-08 12:40 | 12K | ||
| POSCAR.failed2 | 2007-06-10 10:45 | 12K | ||
| POSCAR.k1.run1 | 2007-06-06 15:41 | 7.1K | ||
| POSCAR.k1.run2 | 2007-06-06 16:51 | 12K | ||
| POSCAR.k2.run1 | 2007-06-06 17:52 | 12K | ||
| POSCAR.k2.run2 | 2007-06-06 23:31 | 12K | ||
| POSCAR.k3.run1 | 2007-06-07 13:06 | 12K | ||
| POSCAR.k3.run2 | 2007-06-08 03:28 | 12K | ||
| POSCAR.k4.run1 | 2007-06-10 14:44 | 12K | ||
| POSCAR.k4.run2 | 2007-06-11 07:00 | 12K | ||
| POSCAR.k4.tet.failed | 2007-06-11 19:06 | 12K | ||
| POSCAR.k5.Normal.failed | 2007-06-11 19:06 | 12K | ||
| POSCAR.k5.VeryFast.failed | 2007-06-11 19:06 | 12K | ||
| POSCAR.k5.fast.failed | 2007-06-11 19:06 | 12K | ||
| POTCAR | 2007-06-06 15:41 | 132K | ||
| RunAt | 2007-06-16 02:17 | 98 | ||
| WAVECAR | 2007-06-10 14:04 | 0 | ||
| XDATCAR | 2007-06-16 02:17 | 4.2K | ||
| XDATCAR.failed | 2007-06-10 06:53 | 28K | ||
| XDATCAR.failed2 | 2007-06-10 14:44 | 4.1K | ||
| XDATCAR.k1.run1 | 2007-06-06 16:51 | 40K | ||
| XDATCAR.k1.run2 | 2007-06-06 17:52 | 40K | ||
| XDATCAR.k2.run1 | 2007-06-06 23:31 | 40K | ||
| XDATCAR.k2.run2 | 2007-06-07 13:06 | 40K | ||
| XDATCAR.k3.run1 | 2007-06-08 03:28 | 40K | ||
| XDATCAR.k3.run2 | 2007-06-08 12:40 | 28K | ||
| XDATCAR.k4.run1 | 2007-06-11 07:00 | 12K | ||
| XDATCAR.k4.run2 | 2007-06-11 19:06 | 12K | ||
| XDATCAR.k4.tet.failed | 2007-06-14 17:48 | 4.2K | ||
| XDATCAR.k5.Normal.failed | 2007-06-12 23:22 | 163 | ||
| XDATCAR.k5.VeryFast.failed | 2007-06-14 07:41 | 4.2K | ||
| XDATCAR.k5.fast.failed | 2007-06-13 22:38 | 4.1K | ||
| XYZ | 2007-06-06 15:41 | 8.8K | ||
| XYZ.cont | 2007-09-11 23:16 | 9.6K | ||
| apea.log | 2007-09-11 23:16 | 83 | ||
| apea.struc | 2007-09-11 23:16 | 2.3K | ||
| output | 2007-06-16 02:17 | 12K | ||
| output.failed | 2007-06-10 10:42 | 50K | ||
| output.failed2 | 2007-06-10 14:44 | 18K | ||
| output.k1.run1 | 2007-06-06 16:51 | 12K | ||
| output.k1.run2 | 2007-06-06 17:52 | 10K | ||
| output.k2.run1 | 2007-06-06 23:31 | 10K | ||
| output.k2.run2 | 2007-06-07 13:06 | 9.0K | ||
| output.k3.run1 | 2007-06-08 03:28 | 8.7K | ||
| output.k3.run2 | 2007-06-08 12:40 | 6.0K | ||
| output.k4.run1 | 2007-06-11 07:00 | 3.3K | ||
| output.k4.run2 | 2007-06-11 19:06 | 3.2K | ||
| output.k4.tet.failed | 2007-06-14 17:48 | 3.7K | ||
| output.k5.Normal.failed | 2007-06-13 03:47 | 771K | ||
| output.k5.VeryFast.failed | 2007-06-14 07:41 | 7.2K | ||
| output.k5.fast.failed | 2007-06-13 22:38 | 450K | ||
| pbs_kvasp.o8701 | 2007-06-08 12:40 | 84 | ||
| pbs_kvasp.o8731 | 2007-06-10 10:44 | 140 | ||
| pbs_kvasp.o8815 | 2007-06-10 14:44 | 84 | ||
| pbs_kvasp.o8837 | 2007-06-11 19:06 | 84 | ||
| pbs_kvasp.o8886 | 2007-06-12 10:44 | 893 | ||
| pbs_kvasp.o8959 | 2007-06-14 17:48 | 84 | ||
| pbs_kvasp.o8975 | 2007-06-16 02:17 | 84 | ||
| qvasp.submit | 2007-06-15 17:42 | 59 | ||
| trmap | 2007-09-11 23:16 | 2.1K | ||
| vasprun.xml | 2007-06-16 02:17 | 286K | ||
| vasprun.xml.failed | 2007-06-10 10:42 | 234K | ||
| vasprun.xml.failed2 | 2007-06-10 14:44 | 260K | ||
| vasprun.xml.k1.run1 | 2007-06-06 16:51 | 209K | ||
| vasprun.xml.k1.run2 | 2007-06-06 17:52 | 205K | ||
| vasprun.xml.k2.run1 | 2007-06-06 23:31 | 224K | ||
| vasprun.xml.k2.run2 | 2007-06-07 13:06 | 220K | ||
| vasprun.xml.k3.run1 | 2007-06-08 03:28 | 287K | ||
| vasprun.xml.k3.run2 | 2007-06-08 12:40 | 237K | ||
| vasprun.xml.k4 | 2007-06-03 22:32 | 63K | ||
| vasprun.xml.k4.run1 | 2007-06-11 07:00 | 295K | ||
| vasprun.xml.k4.run2 | 2007-06-11 19:06 | 295K | ||
| vasprun.xml.k4.tet.failed | 2007-06-14 17:48 | 274K | ||
| vasprun.xml.k5.Normal.failed | 2007-06-13 03:32 | 28K | ||
| vasprun.xml.k5.VeryFast.failed | 2007-06-14 07:41 | 481K | ||
| vasprun.xml.k5.fast.failed | 2007-06-13 22:38 | 483K | ||
| xyz.ucell | 2007-09-11 23:16 | 26K | ||
| xyz.unmatched | 2007-09-11 23:16 | 136 | ||
| xyz2pea.cmd | 2007-09-11 23:16 | 21 | ||
| xyz2xyz.rep | 2007-09-11 23:16 | 363 | ||