Concepedia

Hard, transparent, sp3-containing 2D phase formed from few-layer graphene under compression

Luiz G. P. Martins, Diego L. Silva, Jesse S. Smith, Ang‐Yu Lu, Cong Su, Marek Hempel, Connor A. Occhialini, Xiang Ji, Ricardo Pablo, Rafael S. Alencar,

Carbon · 2020 · 46 citations · 53 references

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Concepts

References

53

Generalized Gradient Approximation Made Simple

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

, , +16

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

, , +15

Fast Parallel Algorithms for Short-Range Molecular Dynamics

Steven J. Plimpton · Journal of Computational Physics · 1995 · 44.6K citations

, , +10

A unified formulation of the constant temperature molecular dynamics methods

Shūichi Nosé · The Journal of Chemical Physics · 1984 · 18.9K citations · Full text

, , +15

Efficient pseudopotentials for plane-wave calculations

N. Troullier, José Luı́s Martins · Physical review. B, Condensed matter · 1991 · 16.1K citations

, , +14