Huiqun Zhou wrote: > The straightforward approach is tedious for orthogonal, monoclinic, triclinic > systems. Should the lost implementation gain in these respects?
the lost implementation was written only for the cubic case and only for the bulk modulus, if I remember correctly. Extending it to low-symmetry cases would also be tedious! Paolo -- Paolo Giannozzi, Democritos and University of Udine, Italy
