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Browsing by Author "Saad, Yousef"

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Browsing by Author "Saad, Yousef"

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  • Baroni, Stefano; Gebauer, Ralph; Bariş Malcioğlu, O; Saad, Yousef; Umari, Paolo; Xian, Jiawei (IOP Publishing, 2010-02)
    The recursion method of Haydock, Heine and Kelly is a powerful tool for calculating diagonal matrix elements of the resolvent of quantum-mechanical Hamiltonian operators by elegantly expressing them in terms of continued ...
  • Rocca, Dario; Gebauer, Ralph; Saad, Yousef; Baroni, Stefano (2008-05-14)
    We introduce a new implementation of time-dependent density-functional theory which allows the \emph{entire} spectrum of a molecule or extended system to be computed with a numerical effort comparable to that of a \emph{single} ...

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