Concepedia

Intra- and intermolecular self-assembly of a 20-nm-wide supramolecular hexagonal grid

Zhe Zhang, Yiming Li, Bo Song, Yuan Zhang, Xin Jiang, Ming Wang, Ryan Tumbleson, Changlin Liu, Pingshan Wang, Xin‐Qi Hao,

Nature Chemistry · 2020 · 126 citations · 39 references

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39

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text

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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 · 120.5K citations

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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 · 74.7K citations

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

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1994 · 22.7K citations

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Spin Diffusion Measurements: Spin Echoes in the Presence of a Time-Dependent Field Gradient

E. O. Stejskal, J. E. Tanner · The Journal of Chemical Physics · 1965 · 8.2K citations

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