Concepedia

DFT study of the electronic and optical properties of ternary chalcogenides AlX<sub>2</sub>Te<sub>4</sub>

Sikander Azam, Muhammad Irfan, Zeesham Abbas, Malika Rani, Tahira Saleem, Ayesha Younus, Naseem Akhtar, Bushra Liaqat, Shabbir Muhammad, Abdullah G. Al‐Sehemi

Materials Research Express · 2019 · 58 citations · 23 references

DOI

Concepts

References

23

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 61.8K citations · Full text

, , +16

Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

Fabien Tran, Peter Blaha · Physical Review Letters · 2009 · 5.7K citations

, , +23

A simple effective potential for exchange

Axel D. Becke, Erin R. Johnson · The Journal of Chemical Physics · 2006 · 1.5K citations

Chalcopyrite/defect chalcopyrite heterojunctions on the basis of CuInSe2

D. Schmid, M. Ruckh, F. Grünwald et al. · Journal of Applied Physics · 1993 · 610 citations

, , +17

Hydrogen interactions with defects in crystalline solids

S. M. Myers, M. I. Baskes, J. W. Corbett et al. · Reviews of Modern Physics · 1992 · 527 citations

, , +14