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by gyro555in
Wed Aug 16, 2017 1:19 pm
Forum: Ground state
Topic: Implementing new XC functional
Replies: 0
Views: 1495

Implementing new XC functional

Hello, I am interested in implementing XC functional to fit new QMC data for uniform electron gas at finite temperature (References included below). At the moment there is an exisitng XC at finite temperature implemented in libxc-3.0.0.(xc_lda_xc_ksdt, PRL 112, 076403(2014)) which is inaccurate for ...