CdPt3

CdPt3 is a thermodynamically stable metallic alloy composed of cadmium and platinum that is widely documented for its structural properties.

Crystal structure of CdPt3 (orthorhombic, Cmmm (No. 65))
Ground-state structure · Materials Project
Overview

About CdPt3

CdPt3 is a metallic intermetallic compound belonging to the platinum-group alloy catalyst class. As a thermodynamically stable phase located on the convex hull, it represents a robust configuration of cadmium and platinum atoms that maintains structural integrity under standard conditions.

Its significance lies in its extensive characterization, with numerous reported structures across major materials databases. This high level of data richness makes it a valuable model system for understanding the electronic and structural behavior of platinum-based alloys in catalytic environments.

At a glance

Key Properties

Cross-validated computational properties for CdPt3, aggregated across 5 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
4 DFT sources

Structures

26
5 databases, 7 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for CdPt3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cmmm (No. 65)orthorhombic0.000.0000-4.96318.01
Pm-3m (No. 221)cubic0.000.0077-4.95517.96
R-3m (No. 166)trigonal0.000.1273-4.83617.48
C2 (No. 5)Monoclinic11.67
R-3m (No. 166)Trigonal17.63
Pm-3m (No. 221)Cubic17.95
P-3m1 (No. 164)Trigonal15.40
R-3m (No. 166)Trigonal17.63
Cmmm (No. 65)Orthorhombic17.99
Pm-3m (No. 221)Cubic18.99
17.47
P-6m2 (No. 187)
Uses

Applications

Where CdPt3 is used.

Catalysis researchMaterials science structural modelingIntermetallic alloy development
Reference

Frequently Asked Questions

Common questions about CdPt3, answered from cross-validated data.

What is CdPt3?

CdPt3 is a thermodynamically stable metallic alloy composed of cadmium and platinum that is widely documented for its structural properties.

More questions
What is CdPt3 used for?
CdPt3 is used in catalysis research, materials science structural modeling, and intermetallic alloy development.
What is the band gap of CdPt3?
CdPt3 is computed to be metallic (no band gap) in the reported DFT structures.
Is CdPt3 a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is CdPt3 thermodynamically stable?
Yes — CdPt3 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of CdPt3?
The lowest-energy reported polymorph of CdPt3 is orthorhombic symmetry, space group Cmmm (No. 65).
What is the density of CdPt3?
The computed density of the ground-state structure of CdPt3 is 18.01 g/cm³.
How many polymorphs of CdPt3 are known?
26 structures of CdPt3 are reported across 5 databases, spanning 7 distinct space groups.
What elements does CdPt3 contain?
CdPt3 contains Cd and Pt (2 elements).
Where does the data for CdPt3 come from?
CdPt3 data is cross-referenced from materials_project, mpaloe, omat24, nomad, jarvis.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse family of platinum-group alloys, CdPt3 stands out for its structural stability compared to more complex or less ordered members like As2Pt or Ga2Ru. While many alloys in this class are investigated for their specific surface reactivity, CdPt3 is notable for the high volume of structural data available, positioning it as a well-defined reference point for researchers comparing metallic bonding trends across the series.

Explore

Related Compounds

Other Platinum-Group Alloy 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.
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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