Concepedia

Predicting structural, optoelectronic and mechanical properties of germanium based AGeF3 (A = Ga and In) halides perovskites using the DFT computational approach

Mudasser Husain, Nasir Rahman, Mongi Amami, Tahir Zaman, Mohammad Sohail, Rajwali Khan, Abid Ali Khan, Saima Ahmad Shah, Saeed Ullah, Aurangzeb Khan,

Optical and Quantum Electronics · 2023 · 69 citations · 40 references

DOI

Concepts

References

40

The Elastic Behaviour of a Crystalline Aggregate

R. Hill · Proceedings of the Physical Society Section A · 1952 · 11.2K citations

, , +17

XCII. Relations between the elastic moduli and the plastic properties of polycrystalline pure metals

S.F. Pugh · The London Edinburgh and Dublin Philosophical Magazine and Journal of Science · 1954 · 8.4K citations

, , +15

Full-potential, linearized augmented plane wave programs for crystalline systems

Peter Blaha, Karlheinz Schwarz, P. Sorantin et al. · Computer Physics Communications · 1990 · 3.5K citations

, , +10

New tolerance factor to predict the stability of perovskite oxides and halides

Christopher J. Bartel, Christopher Sutton, Bryan R. Goldsmith et al. · Science Advances · 2019 · 1.7K citations · Full text

, , +15

Density functional theory (DFT) as a powerful tool for designing new organic corrosion inhibitors. Part 1: An overview

I.B. Obot, Digby D. Macdonald, Zuhair M. Gasem · Corrosion Science · 2015 · 1.3K citations

, , +14