Concepedia

Copper single-atom embedded mesoporous carbon nitride: a hybrid material for VOC sensing

Xueze Chu, Clastinrusselraj Indirathankam Sathish, S. Premkumar, Shibo Xi, Jiangtao Qu, Rongkun Zheng, Xiaojiang Yu, Mark B. H. Breese, Dongchen Qi, Wei Li,

Advanced Composites and Hybrid Materials · 2024 · 10 citations · 42 references

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42

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

, , +15

Projector augmented-wave method

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

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Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction

Stefan Grimme · Journal of Computational Chemistry · 2006 · 30.8K citations

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Direct transformation of bulk copper into copper single sites via emitting and trapping of atoms

Yunteng Qu, Zhijun Li, Wenxing Chen et al. · Nature Catalysis · 2018 · 979 citations

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