Ca3CdO4
Ca3CdO4 is a thermodynamically stable, semiconducting oxide material utilized in the study and development of transparent conducting electronics.

About Ca3CdO4
Ca3CdO4 is a semiconducting oxide that maintains thermodynamic stability as a member of the transparent conducting oxide class. Its unique structural arrangement allows it to function within electronic systems where transparency and conductivity are both required for performance. The material is characterized by a robust structural framework, supported by extensive data across multiple research databases. It serves as a specialized candidate for researchers investigating the intersection of calcium-based oxides and electronic transport properties. Its stability makes it an intriguing subject for thin-film development and advanced optoelectronic device integration.
Key Properties
Cross-validated computational properties for Ca3CdO4, aggregated across 4 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.
Cross-Source DFT Agreement
How well independent DFT databases agree on the thermodynamics of Ca3CdO4. Tight agreement means computed properties can be trusted without re-running calculations.
Agreement ScoreA normalized confidence score summarizing how closely independent DFT databases agree. Higher scores mean tighter cross-source agreement.
Hull SpreadDifference between the highest and lowest energy-above-hull values reported by comparable sources. Smaller spread means less thermodynamic disagreement.
Sources ComparedNumber and names of computational sources with comparable entries for this formula.
Space Group ConsensusWhether independent sources predict the same crystal symmetry for the lowest-energy structure.
Reported Structures
Lowest-energy structures reported for Ca3CdO4, 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. |
|---|---|---|---|---|---|
| Cmmm (No. 65) | orthorhombic | 2.52 | 0.0000 | -6.177 | 4.51 |
| P4/mmm (No. 123) | tetragonal | 1.85 | 0.0000 | -2.774 | — |
| — | — | 1.45 | 0.0000 | -2.720 | — |
| P4/mmm (No. 123) | tetragonal | 1.73 | 0.0021 | -6.175 | 4.50 |
| — | — | 2.41 | 0.0025 | -2.717 | — |
| Cmmm (No. 65) | orthorhombic | 2.82 | 0.0093 | -2.764 | — |
| Cmmm (No. 65) | orthorhombic | — | — | — | 4.56 |
| Cmmm (No. 65) | orthorhombic | — | — | — | 4.40 |
| P4/mmm (No. 123) | tetragonal | — | — | — | 4.51 |
| Cmmm (No. 65) | orthorhombic | — | — | — | 4.51 |
| P4/mmm (No. 123) | tetragonal | — | — | — | 4.41 |
| P4/mmm (No. 123) | tetragonal | — | — | — | 4.55 |
Applications
Where Ca3CdO4 is used.
Frequently Asked Questions
Common questions about Ca3CdO4, answered from cross-validated data.
What is Ca3CdO4?
Ca3CdO4 is a thermodynamically stable, semiconducting oxide material utilized in the study and development of transparent conducting electronics.
What is Ca3CdO4 used for?
What is the band gap of Ca3CdO4?
Is Ca3CdO4 a metal, semiconductor, or insulator?
Is Ca3CdO4 thermodynamically stable?
What is the crystal structure of Ca3CdO4?
What is the density of Ca3CdO4?
How many polymorphs of Ca3CdO4 are known?
What elements does Ca3CdO4 contain?
Where does the data for Ca3CdO4 come from?
How It Compares
Within the transparent conducting oxides class.
Within the diverse family of transparent conducting oxides, Ca3CdO4 occupies a distinct niche compared to more common materials like ZnO or BaSnO3. While ZnO is widely utilized for its well-understood electronic properties, Ca3CdO4 offers a different structural complexity that differentiates it from the spinel-structured ZnGa2O4 or the perovskite-like LaGaO3, providing a unique alternative for specific electronic applications.
Related Compounds
Other Transparent Conducting Oxides in the database.
Data sources & attribution
- materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)
- jarvis — Data from JARVIS (jarvis.nist.gov), NIST. Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020). (LicenseRef-US-Gov-PD)
- oqmd — Data from the OQMD (oqmd.org). Cite: Saal et al., JOM 65, 1501 (2013); Kirklin et al., npj Comp. Mater. 1, 15010 (2015). (CC-BY-4.0)
- mpaloe — Data from MP-ALOE. Cite: Kuner et al., npj Comput. Mater. (2025), doi:10.1038/s41524-025-01834-9.
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