Ba4SnN4

Barium tin nitride is a complex inorganic compound composed of barium, tin, and nitrogen. It is primarily studied by researchers for its potential as a precursor material in the synthesis of advanced electronic or optical ceramics.

BaNSn
Crystal structure of Ba4SnN4 (triclinic, P-1 (No. 2))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Ba4SnN4, aggregated across 3 databases.

Band Gap

0.65 eV
Range across DFT structures

Energy Above Hull

0.190 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Ba4SnN4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-1 (No. 2)triclinic0.650.1899-5.5185.76
P-1 (No. 2)Triclinic5.76
P-1 (No. 2)Triclinic5.97
P-1 (No. 2)Triclinic6.07
P-1 (No. 2)
Uses

Applications

Where Ba4SnN4 is used.

Materials science researchSolid-state chemistry studiesPrecursor for advanced ceramic synthesis
Reference

Frequently Asked Questions

Common questions about Ba4SnN4, answered from cross-validated data.

What is Ba4SnN4?

Barium tin nitride is a complex inorganic compound composed of barium, tin, and nitrogen. It is primarily studied by researchers for its potential as a precursor material in the synthesis of advanced electronic or optical ceramics.

More questions
What is Ba4SnN4 used for?
Ba4SnN4 is used in materials science research, solid-state chemistry studies, and precursor for advanced ceramic synthesis.
What is the band gap of Ba4SnN4?
Ba4SnN4 has a DFT-computed band gap of 0.65 eV across 5 reported structures.
Is Ba4SnN4 a metal, semiconductor, or insulator?
With a band gap up to 0.65 eV it is a semiconductor.
Is Ba4SnN4 thermodynamically stable?
Ba4SnN4 has a lowest energy above hull of 0.190 eV/atom (above hull).
What is the crystal structure of Ba4SnN4?
The lowest-energy reported polymorph of Ba4SnN4 is triclinic symmetry, space group P-1 (No. 2).
What is the density of Ba4SnN4?
The computed density of the ground-state structure of Ba4SnN4 is 5.76 g/cm³.
How many polymorphs of Ba4SnN4 are known?
5 structures of Ba4SnN4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba4SnN4 contain?
Ba4SnN4 contains Ba, N, and Sn (3 elements).
Where does the data for Ba4SnN4 come from?
Ba4SnN4 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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