Cl6La2
Lanthanum chloride · Lanthanum(III) chloride
Lanthanum chloride is an inorganic compound that serves as a versatile precursor for the synthesis of various lanthanum-based materials. It is frequently utilized in chemical research and industrial processes due to its ability to act as a catalyst or a starting material for other chemical compounds.
Key Properties
Cross-validated computational properties for Lanthanum chloride, 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.
Reported Structures
Lowest-energy structures reported for Cl6La2, 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. |
|---|---|---|---|---|---|
| P63/m (No. 176) | hexagonal | 3.65 | 0.0000 | -14.754 | 3.78 |
| P63/m (No. 176) | — | 3.85 | — | — | — |
| P63/m (No. 176) | — | 3.74 | — | — | — |
| P63/m (No. 176) | — | 3.72 | — | — | — |
| P63/m (No. 176) | — | 3.69 | — | — | — |
| P63/m (No. 176) | — | 3.62 | — | — | — |
| P63/m (No. 176) | — | 3.60 | — | — | — |
| P63/m (No. 176) | — | 3.28 | — | — | — |
| Cmcm (No. 63) | — | — | — | — | — |
| Pmmn (No. 59) | — | — | — | — | — |
| P63/mmc (No. 194) | — | — | — | — | — |
| — | — | — | — | — | 2.47 |
Applications
Where Lanthanum chloride is used.
Frequently Asked Questions
Common questions about Lanthanum chloride, answered from cross-validated data.
What is Cl6La2?
Lanthanum chloride is an inorganic compound that serves as a versatile precursor for the synthesis of various lanthanum-based materials. It is frequently utilized in chemical research and industrial processes due to its ability to act as a catalyst or a starting material for other chemical compounds.
What is Cl6La2 used for?
What is the band gap of Cl6La2?
Is Cl6La2 a metal, semiconductor, or insulator?
Is Cl6La2 thermodynamically stable?
What is the crystal structure of Cl6La2?
What is the density of Cl6La2?
How many polymorphs of Cl6La2 are known?
What elements does Cl6La2 contain?
Where does the data for Cl6La2 come from?
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).
- aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
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