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Daniel P. Joubert Some formal properties of ensemble density functionals International Journal of Quantum Chemistry 113

Article first published online: 9 MAY 2012 | DOI: 10.1002/qua.24150

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The linear dependence of the ensemble ground state energy on particle number is found in expressions for the difference between energy functionals where the particle number differs by one. It is further reflected in the spatial dependence on particle number of the functional derivatives of the mutual electron–electron repulsion and kinetic energy.

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