Effect of saddle point anisotropy of point defects on their absorption by dislocations and cavities

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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<i>Ab initio</i>molecular dynamics for liquid metals

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<i>Ab initio</i>molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium

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