Orbital Free calculation input

Total energy, geometry optimization, DFT+U, spin....

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Supernova_1986
Posts: 2
Joined: Mon Jun 06, 2016 11:18 am

Orbital Free calculation input

Post by Supernova_1986 » Mon Jun 06, 2016 11:21 am

I'm a new user of abinit code. And I'm very interested in orbital-free calculation.
The newest version of abinit code contains the Thomas-Fermi-vW kinetic functionals.
I wanted to have a try, however there is no tutorial or instruction of orbital-free calculations.

Could you please introduce the keywords?

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