A new release of VASP is available for download now!
This release differs from VASP.6.4.1 by the following changes/additions (amongst others):
Fixes the following known issues:
- Bugs in interface to wannier90.
- Incorrect MLFF fast-mode predictions for some triclinic geometries.
- Fast-mode predictions will crash together with finite difference (IBRION=5,6).
and additionally:
- Added a proper exit if MLFF is encounters multiple atom types with the same label.
- Blocking of scaLAPACK redistribution in MLFF (to reduce memory demands) was not correctly implemented.
- Assorted small fixes and improvements.
Go to the
VASP Portal to get VASP.6.4.2.
This requires a VASP.6 license issued by the VASP Software GmbH.
Get a license!