[QE-users] use of libxc functional

José Carlos Conesa jcconesa at icp.csic.es
Thu Jun 13 13:26:11 CEST 2019


Dear all,

I wish to try in qe the functional HLE17 which is included in libxc 
(with the name MGGA_XC_HLE17); but I do not see any reference to it in 
the Modules/funct.f90 file. Would this be possible?

Regards,

-- 
José C. Conesa
Instituto de Catálisis y Petroleoquímica, CSIC
Marie Curie 2, Madrid, Spain
www.icp.csic.es
Tel. (+34)915854766



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