CrW
Chromium tungsten is a binary intermetallic compound consisting of chromium and tungsten. It is primarily studied for its structural properties and behavior in high-temperature metallurgical environments.
CrW
Overview
Key Properties
Cross-validated computational properties for CrW, aggregated across 5 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.
Metallic / not reported
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.
0.121 eV/atom
Best (lowest) across sources
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.
Above hull
3 DFT sources
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
256
5 databases, 32 space groups
Validation
Cross-Source DFT Agreement
How well independent DFT databases agree on the thermodynamics of CrW. 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.
1.00 / 1.00
Trust tier: medium
Hull SpreadDifference between the highest and lowest energy-above-hull values reported by comparable sources. Smaller spread means less thermodynamic disagreement.
0.000 eV
EAH spread across sources
Sources ComparedNumber and names of computational sources with comparable entries for this formula.
2
jarvis, materials_project
Space Group ConsensusWhether independent sources predict the same crystal symmetry for the lowest-energy structure.
All match
Crystallography
Reported Structures
Lowest-energy structures reported for CrW, 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 | 0.00 | 0.1212 | -33.099 | 13.86 |
| P2/m (No. 10) | Monoclinic | — | — | — | 10.13 |
| P4mm (No. 99) | Tetragonal | — | — | — | 10.05 |
| P4mm (No. 99) | Tetragonal | — | — | — | 11.75 |
| P-1 (No. 2) | Triclinic | — | — | — | 13.14 |
| P4/nmm (No. 129) | Tetragonal | — | — | — | 13.27 |
| P4/nmm (No. 129) | Tetragonal | — | — | — | 16.02 |
| P4/nmm (No. 129) | Tetragonal | — | — | — | 14.20 |
| Pm (No. 6) | Monoclinic | — | — | — | 12.48 |
| P4/nmm (No. 129) | Tetragonal | — | — | — | 15.97 |
| P21 (No. 4) | Monoclinic | — | — | — | 14.32 |
| Cm (No. 8) | Monoclinic | — | — | — | 11.15 |
Uses
Applications
Where CrW is used.
Materials science researchAlloy developmentHigh-temperature structural studies
Reference
Frequently Asked Questions
Common questions about CrW, answered from cross-validated data.
What is CrW?
Chromium tungsten is a binary intermetallic compound consisting of chromium and tungsten. It is primarily studied for its structural properties and behavior in high-temperature metallurgical environments.
More questions
What is CrW used for?
CrW is used in materials science research, alloy development, and high-temperature structural studies.
What is the band gap of CrW?
CrW is computed to be metallic (no band gap) in the reported DFT structures.
Is CrW a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is CrW thermodynamically stable?
CrW has a lowest energy above hull of 0.121 eV/atom (above hull).
What is the crystal structure of CrW?
The lowest-energy reported polymorph of CrW is orthorhombic symmetry, space group Cmmm (No. 65).
What is the density of CrW?
The computed density of the ground-state structure of CrW is 13.86 g/cm³.
How many polymorphs of CrW are known?
256 structures of CrW are reported across 5 databases, spanning 32 distinct space groups.
What elements does CrW contain?
CrW contains Cr and W (2 elements).
Where does the data for CrW come from?
CrW data is cross-referenced from materials_project, mpaloe.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- mpaloe — Data from mpaloe.
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