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Hello,
I would say it should be no problem at all. First of all, this Apple is based
on Intel Xeon CPU (Nehalem or Westmere),
so one can install any Linux distribution on it, and there's no difference at
all between this kind of installation
and any regular workstation running Linux. Secondly,
9790714283
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When you use a recent version of WIEN2k you should NOT play with mixing.
Instead, use
more k-points
TEMP or TEMPS in case.in2 (with increasing broadening parameter).
In case your compond is a Holmium oxide (not clear from the formulae ???)
you may also have to use LDA+U in order to get an
Repeating the same question is not very helpful. Most likely nobody answered
because nobody really knows what exactly your problem is.
a) I assume you are using the most recent WIEN2k version. Some older versions
have a problem.
b) With plotting do you mean charge density plotting ???
Do you
But check the final results with RKMAX 3 or 3.5 !!
Am 29.04.2011 23:44, schrieb Yang Ding:
Dear prof. Marks,
I reduced the Rkmax to 2.5 , and now calculation is going well. Many thanks
for the help!
best regards,
Yang Ding
On 4/28/2011 11:49 PM, Laurence Marks wrote:
The size/plane
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