Commit bbbe0e5a authored by Matthias Redies's avatar Matthias Redies

the "visible" matsize could just be the actual matsize

parent 4cf6e910
......@@ -188,9 +188,8 @@ CONTAINS
!calculate trafo from wavefunctions to APW basis
IF (input%neig < hybdat%nbands(nk)) call judft_error(' mhsfock: neigd < nbands(nk) ;trafo from wavefunctions to APW requires at least nbands(nk)')
call z%init(olap%l_real, nbasfcn, input%neig)
call z%init(olap%l_real, nbasfcn, hybdat%nbands(nk))
call read_z(atoms, cell, hybdat, kpts, sym, noco, input, nk, jsp, z)
z%matsize2 = hybdat%nbands(nk) ! reduce "visible matsize" for the following computations
call olap%multiply(z, trafo)
......
Markdown is supported
0% or
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment