Cu6Pb3S12Si3

This complex sulfide mineral is a rare geological material containing copper, lead, silicon, and sulfur. It is primarily studied by mineralogists and researchers interested in the structural diversity of sulfosalt minerals found in specific hydrothermal environments.

CuPbSSi
Crystal structure of Cu6Pb3S12Si3 (trigonal, P3221 (No. 154))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Cu6Pb3S12Si3, aggregated across 3 databases.

Band Gap

1.34 eV
Range across DFT structures

Energy Above Hull

0.010 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Cu6Pb3S12Si3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P3221 (No. 154)trigonal1.340.0101-4.9525.02
P3221 (No. 154)
5.04
4.89
Uses

Applications

Where Cu6Pb3S12Si3 is used.

Geological researchMineralogical specimen collectionCrystallographic studies
Reference

Frequently Asked Questions

Common questions about Cu6Pb3S12Si3, answered from cross-validated data.

What is Cu6Pb3S12Si3?

This complex sulfide mineral is a rare geological material containing copper, lead, silicon, and sulfur. It is primarily studied by mineralogists and researchers interested in the structural diversity of sulfosalt minerals found in specific hydrothermal environments.

More questions
What is Cu6Pb3S12Si3 used for?
Cu6Pb3S12Si3 is used in geological research, mineralogical specimen collection, and crystallographic studies.
What is the band gap of Cu6Pb3S12Si3?
Cu6Pb3S12Si3 has a DFT-computed band gap of 1.34 eV across 4 reported structures.
Is Cu6Pb3S12Si3 a metal, semiconductor, or insulator?
With a band gap up to 1.34 eV it is a semiconductor.
Is Cu6Pb3S12Si3 thermodynamically stable?
Cu6Pb3S12Si3 has a lowest energy above hull of 0.010 eV/atom (near hull (likely stable)).
What is the crystal structure of Cu6Pb3S12Si3?
The lowest-energy reported polymorph of Cu6Pb3S12Si3 is trigonal symmetry, space group P3221 (No. 154).
What is the density of Cu6Pb3S12Si3?
The computed density of the ground-state structure of Cu6Pb3S12Si3 is 5.02 g/cm³.
How many polymorphs of Cu6Pb3S12Si3 are known?
4 structures of Cu6Pb3S12Si3 are reported across 3 databases, spanning 1 distinct space group.
What elements does Cu6Pb3S12Si3 contain?
Cu6Pb3S12Si3 contains Cu, Pb, S, and Si (4 elements).
Where does the data for Cu6Pb3S12Si3 come from?
Cu6Pb3S12Si3 data is cross-referenced from materials_project, aflow, omat24.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • 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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