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Sunday, August 20, 2017

NEW RELEASE: VASP.5.4.4

A new release of VASP, version 5.4.4.18Apr17, is available for download now (for all holders of a valid "VASP.5.2" license)!

List of changes:
We will not attempt to explicitly list changes, there are simply too many.

Changes include:

  • Bugfixes and stability enhancements.
  • Additional functionality: most notably perhaps, this version of VASP includes the SCAN metaGGA functional (and SCAN+rVV10).
  • Performance improvements for the GPU port.
  • Changes to enable compilation with the PGI compiler (tested with version >= 16.10).