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Bonding Scheme and Optical Properties in BiM2 O2 (PO4 ) (M=Cd, Mg, Zn); Experimental and Theoretical Analysis
J Olchowka1,2, O Mentré2, H Kabbour2
1University of Siegen, Department Chemistry/Biology, Faculty of Science and Technology, 57068, Siegen, Germany.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|October 17, 2017
Summary
This study reveals bright warm white luminescence in Bi(M,M′)₂PO₆ materials, tunable by altering M elements. These findings pave the way for novel phosphors with tailored optical properties.
Area of Science:
- Solid-state chemistry
- Materials science
- Luminescence
Background:
- Bismuth-containing compounds are explored for luminescence applications.
- Understanding structure-property relationships is key for designing new materials.
Purpose of the Study:
- To rationalize the luminescence properties of Bi(M,M′)₂PO₆ series.
- To investigate the influence of M elements (Mg, Zn, Cd) on optical characteristics.
- To explore tunable optical properties in related systems.
Main Methods:
- Optical spectroscopy was employed to study luminescence.
- Empirical and first-principles calculations were used for electronic structure analysis.
- Correlation between lone pair activity and emission energy was established.
Main Results:
- Bright warm white luminescence was observed at room temperature, with high quantum yield (e.g., 22.8% for M=Mg).
- Band gaps were calculated between 2.64–3.62 eV.
- Excitation processes higher than band gaps, attributed to Bi³⁺ transitions, were identified.
- Tunable optical properties were demonstrated in the BiMg₂₋ₓCdₓPO₆ system.
Conclusions:
- Luminescence properties are directly influenced by the M element in Bi(M,M′)₂PO₆.
- The lone pair activity and lattice parameters govern emission energy.
- The Bi₂O₃-MO-X₂O₅ system offers realistic potential for tunable optical materials.
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