small modification for consistency, again

git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@9357 c92efa57-630b-4861-b058-cf58834340f0
This commit is contained in:
oliviero 2012-08-21 18:27:47 +00:00
parent d8c7ae4302
commit dfe7b47fb3
1 changed files with 5 additions and 3 deletions

View File

@ -445,9 +445,11 @@ CONTAINS
!
! ... minimum image convention
!
s(:) = MATMUL( r(:), bg(:,:) )
s(:) = s(:) - ANINT(s(:))
r(:) = MATMUL( at(:,:), s(:) )
CALL cryst_to_cart( 1, r, bg, -1 )
!
r(:) = r(:) - ANINT( r(:) )
!
CALL cryst_to_cart( 1, r, at, 1 )
!
axis(ir) = r(icor)
!