Gong,
As the message clearly says you need Libxc to be installed.
If you had googled it you would have found the following link:
http://www.tddft.org/programs/octopus/wiki/index.php/Libxc
Éric.
On 04/02/2015 07:32 PM, plgong wrote:
Dear professor,
Recenetly, I found that tb09 (meta-GGA) can ue used in the version of QE
5.1.2, but when I run an
example, it reported that,
" Error in routine tb09 (1):
need libxc
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine tb09 (1):
need libxc
"
I have used "input_dft='tb09' in my inputfile.
I have no idea about libxc, Do I need to install it? How can I do?
pPlease help me at a time most convenient to you.
Best wishes
P. L. Gong
Addr: Institute of Solid State Physics, Chinese Academy of
Sciences, Hefei, Anhui 230031, China
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Éric Germaneau (艾海克), Specialist
Center for High Performance Computing
Shanghai Jiao Tong University
Room 205 Network Center, 800 Dongchuan Road, Shanghai 200240 China
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