Introduction to Density Functional Theory
•Compute the kinetic energy of a density by assuming that the density corresponds to a wavefunction consisting of a single Slater determinant (“non-interacting limit”): we know how to compute the kinetic energy of a Slater determinant (orbitals) --- looks same as Hartree-Fock Theory •This procedure is called Kohn-Sham DFT and is the ...
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