BiBO2

Bismuth borate · BBO

Bismuth borate is a synthetic crystalline material widely recognized for its unique optical properties. It is primarily utilized in advanced laser systems and photonics research to manipulate light frequencies through nonlinear optical processes.

BBiO
Overview

Key Properties

Cross-validated computational properties for Bismuth borate, aggregated across 3 databases.

Band Gap

3.43–3.96 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

9
3 databases, 6 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for BiBO2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pca21 (No. 29)orthorhombic3.860.0000-7.94911.87
P21/c (No. 14)monoclinic3.430.0052-7.94411.54
P21/c (No. 14)monoclinic3.960.0103-7.93910.13
P1 (No. 1)triclinic3.870.0164-7.9328.84
C2 (No. 5)monoclinic3.840.0187-7.9309.26
P21/m (No. 11)Monoclinic5.71
P21/m (No. 11)Monoclinic6.73
P21/m (No. 11)Monoclinic6.74
P4mm (No. 99)
Uses

Applications

Where Bismuth borate is used.

Laser frequency conversionNonlinear opticsOptical signal processingScientific research
Reference

Frequently Asked Questions

Common questions about Bismuth borate, answered from cross-validated data.

What is BiBO2?

Bismuth borate is a synthetic crystalline material widely recognized for its unique optical properties. It is primarily utilized in advanced laser systems and photonics research to manipulate light frequencies through nonlinear optical processes.

More questions
What is BiBO2 used for?
Bismuth borate (BiBO2) is used in laser frequency conversion, nonlinear optics, optical signal processing, and scientific research.
What is the band gap of BiBO2?
Bismuth borate (BiBO2) has a DFT-computed band gap of 3.43–3.96 eV across 9 reported structures.
Is BiBO2 a metal, semiconductor, or insulator?
With a wide band gap up to 3.96 eV it is an insulator / wide-band-gap material.
Is BiBO2 thermodynamically stable?
Yes — Bismuth borate (BiBO2) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of BiBO2?
The lowest-energy reported polymorph of Bismuth borate (BiBO2) is orthorhombic symmetry, space group Pca21 (No. 29).
What is the density of BiBO2?
The computed density of the ground-state structure of Bismuth borate (BiBO2) is 11.87 g/cm³.
How many polymorphs of BiBO2 are known?
9 structures of BiBO2 are reported across 3 databases, spanning 6 distinct space groups.
What elements does BiBO2 contain?
Bismuth borate (BiBO2) contains B, Bi, and O (3 elements).
Where does the data for BiBO2 come from?
BiBO2 data is cross-referenced from materials_project, mpaloe, jarvis.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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