A Defect-Driven Metal-free Electrocatalyst for Oxygen Reduction in Acidic Electrolyte

Generalized Gradient Approximation Made Simple

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Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

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Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

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Soft self-consistent pseudopotentials in a generalized eigenvalue formalism

David Vanderbilt · Physical review. B, Condensed matter · 1990 · 22.9K citations

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