BaInLaMnO6
BaInLaMnO6 is a semiconducting complex oxide composed of barium, indium, lanthanum, and manganese that exhibits metastable thermodynamic characteristics.
About BaInLaMnO6
BaInLaMnO6 is a complex quaternary oxide incorporating barium, indium, lanthanum, and manganese. As a semiconducting material, it represents an interesting subject for solid-state research into the electronic behavior of multi-element oxide systems.
While the compound has been documented across multiple structural databases, it is characterized as being thermodynamically above the hull. This suggests that the phase may be metastable or require specific synthesis conditions to stabilize its crystalline architecture.
Key Properties
Cross-validated computational properties for BaInLaMnO6, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Reported Structures
Lowest-energy structures reported for BaInLaMnO6, ranked by energy above hull.
| Space GroupSymmetry classification of the crystal arrangement. The number is the international space-group index. | Crystal SystemBroad lattice family, such as cubic, tetragonal, monoclinic, or triclinic, derived from unit-cell symmetry. | Band Gap (eV)Electronic gap calculated for this specific reported structure, measured in electronvolts. | E above hull (eV/atom)Thermodynamic distance from the convex hull for this structure, normalized per atom. Lower is generally more stable. | E/atom (eV)Computed total energy normalized per atom. Use energy above hull, not this value alone, when comparing stability. | Density (g/cm³)Mass per relaxed crystal volume, reported in grams per cubic centimeter. |
|---|---|---|---|---|---|
| Pmna (No. 53) | orthorhombic | 0.00 | 0.1200 | -7.479 | 6.60 |
| F-43m (No. 216) | cubic | 0.71 | 0.1549 | -7.444 | 6.75 |
| F-43m (No. 216) | cubic | 0.00 | 0.4886 | -7.110 | 5.96 |
| Pmna (No. 53) | — | — | — | — | — |
| — | — | — | — | — | 6.75 |
Frequently Asked Questions
Common questions about BaInLaMnO6, answered from cross-validated data.
What is BaInLaMnO6?
BaInLaMnO6 is a semiconducting complex oxide composed of barium, indium, lanthanum, and manganese that exhibits metastable thermodynamic characteristics.
What is the band gap of BaInLaMnO6?
Is BaInLaMnO6 a metal, semiconductor, or insulator?
Is BaInLaMnO6 thermodynamically stable?
What is the crystal structure of BaInLaMnO6?
What is the density of BaInLaMnO6?
How many polymorphs of BaInLaMnO6 are known?
What elements does BaInLaMnO6 contain?
Where does the data for BaInLaMnO6 come from?
How It Compares
As a unique complex oxide, BaInLaMnO6 serves as a specialized example of how the integration of rare-earth and transition metal elements influences the electronic landscape of perovskite-related structures.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
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