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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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Ab initio molecular dynamics for liquid metals

Georg Kresse · Journal of Non-Crystalline Solids · 1995 · 2.1K citations

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