Be2Si

Beryllium silicide is a binary inorganic compound composed of beryllium and silicon. It is primarily studied in the context of materials science for its structural properties and potential use in specialized high-performance applications.

Crystal structure of Be2Si (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Be2Si, aggregated across 4 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.259 eV/atom
Best (lowest) across sources

Stability

Above hull
3 DFT sources

Structures

85
4 databases, 18 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Be2Si, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fm-3m (No. 225)cubic0.000.2588-4.0432.08
I212121 (No. 24)Orthorhombic1.41
Cmcm (No. 63)Orthorhombic2.47
Cmcm (No. 63)Orthorhombic2.06
Cm (No. 8)Monoclinic1.90
P21/m (No. 11)Monoclinic3.76
Cmcm (No. 63)Orthorhombic2.11
Cmcm (No. 63)Orthorhombic2.52
I212121 (No. 24)Orthorhombic1.28
Cm (No. 8)Monoclinic1.70
Cm (No. 8)Monoclinic1.70
C2/m (No. 12)Monoclinic1.38
Uses

Applications

Where Be2Si is used.

Materials science researchSemiconductor studiesAdvanced ceramic development
Reference

Frequently Asked Questions

Common questions about Be2Si, answered from cross-validated data.

What is Be2Si?

Beryllium silicide is a binary inorganic compound composed of beryllium and silicon. It is primarily studied in the context of materials science for its structural properties and potential use in specialized high-performance applications.

More questions
What is Be2Si used for?
Be2Si is used in materials science research, semiconductor studies, and advanced ceramic development.
What is the band gap of Be2Si?
Be2Si is computed to be metallic (no band gap) in the reported DFT structures.
Is Be2Si a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is Be2Si thermodynamically stable?
Be2Si has a lowest energy above hull of 0.259 eV/atom (above hull).
What is the crystal structure of Be2Si?
The lowest-energy reported polymorph of Be2Si is cubic symmetry, space group Fm-3m (No. 225).
What is the density of Be2Si?
The computed density of the ground-state structure of Be2Si is 2.08 g/cm³.
How many polymorphs of Be2Si are known?
85 structures of Be2Si are reported across 4 databases, spanning 18 distinct space groups.
What elements does Be2Si contain?
Be2Si contains Be and Si (2 elements).
Where does the data for Be2Si come from?
Be2Si data is cross-referenced from materials_project, mpaloe.
Explore

Related Compounds

Other Silicon Anode Materials in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.

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