Concepedia

Deciphering chemical order/disorder and material properties at the single-atom level

Yongsoo Yang, Chien-Chun Chen, Mary Scott, Colin Ophus, Rui Xu, Alan Pryor, Wu Li, Fan Sun, Wolfgang Theis, Jihan Zhou,

Nature · 2017 · 360 citations · 61 references

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References

61

Projector augmented-wave method

Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations

, , +17

From ultrasoft pseudopotentials to the projector augmented-wave method

Georg Kresse, Daniel P. Joubert · Physical review. B, Condensed matter · 1999 · 83.6K citations

, , +17

Crystallography & NMR System: A New Software Suite for Macromolecular Structure Determination

Axel T. Brünger, Paul D. Adams, G. Marius Clore et al. · Acta Crystallographica Section D Biological Crystallography · 1998 · 15.8K citations

, , +17

Ground State of the Electron Gas by a Stochastic Method

David M. Ceperley, B. J. Alder · Physical Review Letters · 1980 · 14.2K citations

, , +16

A Study of Cross-Validation and Bootstrap for Accuracy Estimation and Model Selection

Ron Kohavi · 1995 · 10.7K citations · Full text

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