Concepedia

Li-decorated double vacancy graphene for hydrogen storage application: A first principles study

S. Seenithurai, R. Kodi Pandyan, Sandeep Kumar, C. Saranya, M. Mahendran

International Journal of Hydrogen Energy · 2014 · 159 citations · 76 references

DOI

Concepts

References

76

Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

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Accurate and simple analytic representation of the electron-gas correlation energy

John P. Perdew, Yue Wang · Physical review. B, Condensed matter · 1992 · 24.9K citations

, , +14

Graphene-based composite materials

Sasha Stankovich, Dmitriy A. Dikin, Geoffrey Dommett et al. · Nature · 2006 · 12.8K citations

From molecules to solids with the DMol3 approach

B. Delley · The Journal of Chemical Physics · 2000 · 10.9K citations · Full text

, , +12

An all-electron numerical method for solving the local density functional for polyatomic molecules

B. Delley · The Journal of Chemical Physics · 1990 · 10.5K citations · Full text

, , +15