Hsin-Yu Ho and Marcos Calegari Andrade for this and more meta-GGA work to come.
We reached revision 14000: this might be a good point to move to gitlab.
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@14000 c92efa57-630b-4861-b058-cf58834340f0
Silicon band structure is ok, but silicon total energy is off by ~4.5 Ry!
IMPORTANT: must link with libxc trunk from svn (i.e. libxc>3.0.0)!
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@13436 c92efa57-630b-4861-b058-cf58834340f0
moment to get rid of flib/, whose usefulness is far from obvious. The content
of flib/ is now in Modules/. Many makefiles updated and little more.
Packages using QE routines should just remove links to flib/flib.a.
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@12072 c92efa57-630b-4861-b058-cf58834340f0
Modules/vxccg.f90 split into atomic/vxcgc.f90 and flib/radial_gradients.f90
Modules/metagga.f90 moved to flib/metagga.f90
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5884 c92efa57-630b-4861-b058-cf58834340f0
CMPLX is explicitly typed, blas/lapack are lowercase (consistently with
the convention: FORTRAN COMMANDS = uppercase, all the rest lowercase)
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@5789 c92efa57-630b-4861-b058-cf58834340f0
Please do not re-introduce old-style syntax. A uniform syntax allows
if the need arises to change the precision in less than no time.
Courtesy of Pascal Thibeaudeau. Modules/ directory only.
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3964 c92efa57-630b-4861-b058-cf58834340f0
Pietro Bonfa