BaCuO2
Barium cuprate · Barium copper oxide
Barium cuprate is a ceramic material known for its role as a precursor in the synthesis of high-temperature superconducting compounds. It is frequently studied for its structural properties and its ability to facilitate the formation of complex copper-oxide phases.
Key Properties
Cross-validated computational properties for Barium cuprate, 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 BaCuO2, 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. |
|---|---|---|---|---|---|
| Cmcm (No. 63) | orthorhombic | 0.00 | 0.0000 | -5.970 | 5.80 |
| P4/mmm (No. 123) | tetragonal | 0.00 | 0.0773 | -5.893 | 6.16 |
| Pmma (No. 51) | orthorhombic | 0.00 | 0.1011 | -5.869 | 5.87 |
| Cmmm (No. 65) | orthorhombic | 0.28 | 0.1050 | -5.865 | 6.06 |
| Pbam (No. 55) | orthorhombic | 0.00 | 0.1098 | -5.861 | 5.79 |
| P21212 (No. 18) | orthorhombic | 0.00 | 0.1119 | -5.859 | 6.07 |
| Pbam (No. 55) | orthorhombic | 0.19 | 0.1140 | -5.857 | 6.09 |
| Pbam (No. 55) | orthorhombic | 0.00 | 0.1141 | -5.856 | 5.79 |
| Pbam (No. 55) | Orthorhombic | — | — | — | 6.09 |
| P4/mmm (No. 123) | — | — | — | — | — |
| Pbcm (No. 57) | — | — | — | — | — |
| Pbam (No. 55) | Orthorhombic | — | — | — | 6.31 |
Synthesis Routes
Literature-extracted synthesis procedures targeting BaCuO2.
Applications
Where Barium cuprate is used.
Frequently Asked Questions
Common questions about Barium cuprate, answered from cross-validated data.
What is BaCuO2?
Barium cuprate is a ceramic material known for its role as a precursor in the synthesis of high-temperature superconducting compounds. It is frequently studied for its structural properties and its ability to facilitate the formation of complex copper-oxide phases.
What is BaCuO2 used for?
What is the band gap of BaCuO2?
Is BaCuO2 a metal, semiconductor, or insulator?
Is BaCuO2 thermodynamically stable?
What is the crystal structure of BaCuO2?
What is the density of BaCuO2?
How many polymorphs of BaCuO2 are known?
How is BaCuO2 synthesized?
What elements does BaCuO2 contain?
Where does the data for BaCuO2 come from?
Related Compounds
Other Spinel Oxide Catalysts 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.
- jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
Analyze BaCuO2 in the Lattice Graph platform
Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.
Explore the Platform →