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20022026
most citedMagnetism, superconductivity, and pairing symmetry in Fe-based superconductors

715 citations

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cond-mat.mtrl-sci2004★ 1 cited

Analytical Hartree-Fock gradients with respect to the cell parameter for systems periodic in three dimensions

K. Doll, R. Dovesi, R. Orlando

Analytical Hartree-Fock gradients with respect to the cell parameter have been implemented in the electronic structure code CRYSTAL, for the case of three-dimensional periodicity.…