Concepedia
Nature Materials · 2023 · 48 citations · 46 references
Fractured DiamondSelf-healing MaterialSelf-repairWound HealingSelf-healing SurfaceMedicineOrthopaedic SurgerySelf-healing Materials
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Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set
Georg Kresse, J. Furthmüller · Physical review. B, Condensed matter · 1996 · 116.1K citations
Numerical Analysis, Engineering, Computational Chemistry +17
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
Georg Kresse, J. Furthmüller · Computational Materials Science · 1996 · 72.1K citations
Semiconductors, Engineering, Physics +9
A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
Stefan Grimme, Jens Antony, Stephan Ehrlich et al. · The Journal of Chemical Physics · 2010 · 53.8K citations
Engineering, Physics, Natural Sciences +11
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
John P. Perdew, J. A. Chevary, S. H. Vosko et al. · Physical review. B, Condensed matter · 1992 · 21.7K citations
Engineering, Computational Chemistry, Chemistry +16
The Elastic Behaviour of a Crystalline Aggregate
R. Hill · Proceedings of the Physical Society Section A · 1952 · 10.8K citations
Engineering, Micromechanics, Mechanical Engineering +16