We are pleased to announce Siesta 5.0.2, the second point release of Siesta 5.0. Siesta 5.0.2 incorporates the following changes:
Improvements to the handling of the GPU set-string and kernel names for ELPA.
Fixed bug in pressure annealing scaling factor which resulted in incorrect behaviour of the method, as presented in https://gitlab.com/siesta-project/siesta/-/issues/30.
Fixed the version generation script to print proper version numbers.
Fixed missing rcore initialization in atom.F.
Improved documentation for GF file options.
Bumped libgridxc version to 2.0.2 to prevent issues with VdW functionals.