quantum-espresso/test-suite/pw_hse
giannozz 802b1c08c7 The choice of k-points in the HSE example was less than ideal: the provided
list of k-points was supposed to be equivalent to the automatic 4 4 4 1 1 1 
grid, but it turns out not to be as "equivalent" as expected. As a consequence
additional k+q-points were used in the calculation of the exact exchange term.
Note that manual points from "k-points.x" work instead as expected. I guess 
it is another turn of the "displaced grid not having the full symmetry of the 
crystal" problem.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@12213 c92efa57-630b-4861-b058-cf58834340f0
2016-03-14 21:07:30 +00:00
..
benchmark.out.v5.3.0.inp=hse-si111.in The choice of k-points in the HSE example was less than ideal: the provided 2016-03-14 21:07:30 +00:00
benchmark.out.v5.3.0.inp=hse-si222.in The choice of k-points in the HSE example was less than ideal: the provided 2016-03-14 21:07:30 +00:00
benchmark.out.v5.3.0.inp=hse-si444.in The choice of k-points in the HSE example was less than ideal: the provided 2016-03-14 21:07:30 +00:00
hse-si111.in The choice of k-points in the HSE example was less than ideal: the provided 2016-03-14 21:07:30 +00:00
hse-si222.in The choice of k-points in the HSE example was less than ideal: the provided 2016-03-14 21:07:30 +00:00
hse-si444.in The choice of k-points in the HSE example was less than ideal: the provided 2016-03-14 21:07:30 +00:00