internal error in GENERATE_KPOINTS_TRANS: number of G-vector changed in star 70552 70554
Posted: Fri Mar 10, 2023 10:57 am
I encountered one bug report when calculating phonon dispersion with DFPT:
-----------------------------------------------------------------------------
| _ ____ _ _ _____ _ |
| | | | _ \ | | | | / ____| | | |
| | | | |_) | | | | | | | __ | | |
| |_| | _ < | | | | | | |_ | |_| |
| _ | |_) | | |__| | | |__| | _ |
| (_) |____/ \____/ \_____| (_) |
| |
| internal error in: mkpoints_change.F at line: 786 |
| |
| internal error in GENERATE_KPOINTS_TRANS: number of G-vector |
| changed in star 70552 70554 |
| |
| If you are not a developer, you should not encounter this problem. |
| Please submit a bug report. |
| |
-----------------------------------------------------------------------------
This can also be seen in the vasp.err file.
I provide all the calculation files in the attachment.
-----------------------------------------------------------------------------
| _ ____ _ _ _____ _ |
| | | | _ \ | | | | / ____| | | |
| | | | |_) | | | | | | | __ | | |
| |_| | _ < | | | | | | |_ | |_| |
| _ | |_) | | |__| | | |__| | _ |
| (_) |____/ \____/ \_____| (_) |
| |
| internal error in: mkpoints_change.F at line: 786 |
| |
| internal error in GENERATE_KPOINTS_TRANS: number of G-vector |
| changed in star 70552 70554 |
| |
| If you are not a developer, you should not encounter this problem. |
| Please submit a bug report. |
| |
-----------------------------------------------------------------------------
This can also be seen in the vasp.err file.
I provide all the calculation files in the attachment.