InS
Indium monosulfide · Indium(II) sulfide
Indium monosulfide is a binary inorganic compound composed of indium and sulfur. It is primarily studied for its semiconducting properties and potential utility in optoelectronic devices and thin-film technologies.
InS
Overview
Key Properties
Cross-validated computational properties for Indium monosulfide, 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.
0.44–1.35 eV
Range across DFT structures
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.
0.000 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.
On hull (stable)
3 DFT sources
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
84
5 databases, 23 space groups
Validation
Cross-Source DFT Agreement
How well independent DFT databases agree on the thermodynamics of InS. 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: high
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.
3
jarvis, materials_project, nomad
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 InS, 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. |
|---|---|---|---|---|---|
| Pnnm (No. 58) | orthorhombic | 1.35 | 0.0000 | -15.990 | 4.92 |
| P21/c (No. 14) | monoclinic | 0.44 | 0.0278 | -15.962 | 5.18 |
| P1 (No. 1) | Triclinic | — | — | — | 5.50 |
| No. 0 | unknown | — | — | — | 1.31 |
| R-3m (No. 166) | Trigonal | — | — | — | 4.43 |
| I4/mcm (No. 140) | — | — | — | — | — |
| Cm (No. 8) | Monoclinic | — | — | — | 8.15 |
| R-3m (No. 166) | Trigonal | — | — | — | 3.93 |
| C2 (No. 5) | Monoclinic | — | — | — | 6.53 |
| Pc (No. 7) | Monoclinic | — | — | — | 4.38 |
| P1 (No. 1) | Triclinic | — | — | — | 4.10 |
| P-1 (No. 2) | Triclinic | — | — | — | 4.35 |
Uses
Applications
Where Indium monosulfide is used.
Photovoltaic researchOptoelectronic device developmentSemiconductor material studies
Reference
Frequently Asked Questions
Common questions about Indium monosulfide, answered from cross-validated data.
What is InS?
Indium monosulfide is a binary inorganic compound composed of indium and sulfur. It is primarily studied for its semiconducting properties and potential utility in optoelectronic devices and thin-film technologies.
More questions
What is InS used for?
Indium monosulfide (InS) is used in photovoltaic research, optoelectronic device development, and semiconductor material studies.
What is the band gap of InS?
Indium monosulfide (InS) has a DFT-computed band gap of 0.44–1.35 eV across 84 reported structures.
Is InS a metal, semiconductor, or insulator?
With a band gap up to 1.35 eV it is a semiconductor.
Is InS thermodynamically stable?
Yes — Indium monosulfide (InS) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of InS?
The lowest-energy reported polymorph of Indium monosulfide (InS) is orthorhombic symmetry, space group Pnnm (No. 58).
What is the density of InS?
The computed density of the ground-state structure of Indium monosulfide (InS) is 4.92 g/cm³.
How many polymorphs of InS are known?
84 structures of InS are reported across 5 databases, spanning 23 distinct space groups.
What elements does InS contain?
Indium monosulfide (InS) contains In and S (2 elements).
Where does the data for InS come from?
InS data is cross-referenced from materials_project, mpaloe, cod, nomad.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- mpaloe — Data from mpaloe.
- cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
- nomad — Data from NOMAD. Cite: Draxl & Scheffler, J. Phys. Mater. 2, 036001 (2019).
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