05 December 2019 1 8K Report

What is significance of following parameters in *.out file after SIESTA run ????

(Free)E+ p_basis*V_orbitals = -6655.206619

(Free)Eharris+ p_basis*V_orbitals = -6655.206622

spin moment: S , {S} = -0.00000 0.0 0.0 -0.00000

What are the information we get from it ?

I have attached sample for easy understanding.

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