Be2Os1Zn1

This is a ternary intermetallic compound composed of beryllium, osmium, and zinc. It is primarily studied in materials science research for its structural properties and potential electronic characteristics within the context of complex metallic alloys.

BeOsZn
Crystal structure of Be2Os1Zn1 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Be2Os1Zn1, aggregated across 2 databases.

Band Gap

0.41 eV
Range across DFT structures

Energy Above Hull

2.845 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

26
2 databases, 16 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Be2Os1Zn1, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.412.8449-2.3070.81
I4/mmm (No. 139)
Fm-3m (No. 225)
Imm2 (No. 44)
P4/mmm (No. 123)
Cmmm (No. 65)
R-3m (No. 166)
C2/m (No. 12)
Imm2 (No. 44)
P4/mmm (No. 123)
Cmmm (No. 65)
I-4m2 (No. 119)
Uses

Applications

Where Be2Os1Zn1 is used.

Materials science researchSolid-state physics studies
Reference

Frequently Asked Questions

Common questions about Be2Os1Zn1, answered from cross-validated data.

What is Be2Os1Zn1?

This is a ternary intermetallic compound composed of beryllium, osmium, and zinc. It is primarily studied in materials science research for its structural properties and potential electronic characteristics within the context of complex metallic alloys.

More questions
What is Be2Os1Zn1 used for?
Be2Os1Zn1 is used in materials science research and solid-state physics studies.
What is the band gap of Be2Os1Zn1?
Be2Os1Zn1 has a DFT-computed band gap of 0.41 eV across 26 reported structures.
Is Be2Os1Zn1 a metal, semiconductor, or insulator?
With a band gap up to 0.41 eV it is a semiconductor.
Is Be2Os1Zn1 thermodynamically stable?
Be2Os1Zn1 has a lowest energy above hull of 2.845 eV/atom (above hull).
What is the crystal structure of Be2Os1Zn1?
The lowest-energy reported polymorph of Be2Os1Zn1 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Be2Os1Zn1?
The computed density of the ground-state structure of Be2Os1Zn1 is 0.81 g/cm³.
How many polymorphs of Be2Os1Zn1 are known?
26 structures of Be2Os1Zn1 are reported across 2 databases, spanning 16 distinct space groups.
What elements does Be2Os1Zn1 contain?
Be2Os1Zn1 contains Be, Os, and Zn (3 elements).
Where does the data for Be2Os1Zn1 come from?
Be2Os1Zn1 data is cross-referenced from materials_project, aflow.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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