Concepedia

Donor-Acceptor structural polymeric carbon nitride with in-plane electric field accelerating charge separation for efficient photocatalytic hydrogen evolution

Zengjian Liu, Jin Zhang, Yingfei Wan, Jinwei Chen, Yufeng Zhou, Jie Zhang, Gang Wang, Ruilin Wang

Chemical Engineering Journal · 2021 · 74 citations · 52 references

DOI

Concepts

References

52

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 203.9K citations · Full text

, , +19

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 · 116.1K citations

, , +17

Projector augmented-wave method

Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 87.4K citations

, , +19

From ultrasoft pseudopotentials to the projector augmented-wave method

Georg Kresse, Daniel P. Joubert · Physical review. B, Condensed matter · 1999 · 80.7K citations

, , +18

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 · 72.1K citations

, , +9