scnc
/
quantum-espresso
mirror of https://gitlab.com/QEF/q-e.git
1
0
Fork 0
Code Issues Packages Projects Releases Wiki Activity

Documentation for projwfc updated (should have been done yesterday) 

git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@6843 c92efa57-630b-4861-b058-cf58834340f0
This commit is contained in:
giannozz 2010-06-15 13:23:47 +00:00
parent c680c542e6
commit 4c450be68c
1 changed files with 13 additions and 0 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

13
doc-def/INPUT_PROJWFC.def
View File

@ -78,6 +78,15 @@ input_description -distribution {Quantum Espresso} -package PWscf -program projw
}
}
var kresolveddos -type LOGICAL {
default { .false. }
info {
if .true. the k-resolved DOS is computed: not summed over
all k-points but written as a function of the k-point index.
In this case all k-point weights are set to unity
}
}
var tdosinboxes -type LOGICAL {
default { .false. }
info {
@ -171,6 +180,10 @@ input_description -distribution {Quantum Espresso} -package PWscf -program projw
E LDOS(E) PDOS_1(E) ... PDOS_2j+1(E)
...
If kresolveddos=.true., the k-point index is prepended
to the formats above, e.g. (collinear, spin-unpolarized case)
ik E DOS(E) PDOS(E)
All DOS(E) are in states/eV plotted vs E in eV
}
}