Slot: surface_energy
Cleavage energy per unit area required to create the surface from the bulk.
A lower value indicates a more stable surface facet.
URI: coremeta4cat:surface_energy Alias: surface_energy
Applicable Classes
| Name | Description | Modifies Slot |
|---|---|---|
| Surfaces | Surface properties of a catalyst computed from a periodic slab model, including surface energy, Miller index, slab thickness, and vacuum spacing. Central to heterogeneous catalysis modelling. |
no |
Properties
-
Range: Float
-
Multivalued: True
Identifier and Mapping Information
Schema Source
- from schema: https://w3id.org/nfdi4cat/coremeta4cat
Mappings
| Mapping Type | Mapped Value |
|---|---|
| self | coremeta4cat:surface_energy |
| native | coremeta4cat:surface_energy |
LinkML Source
name: surface_energy
description: 'Cleavage energy per unit area required to create the surface from the
bulk.
A lower value indicates a more stable surface facet.'
from_schema: https://w3id.org/nfdi4cat/coremeta4cat
rank: 1000
slot_uri: coremeta4cat:surface_energy
alias: surface_energy
domain_of:
- Surfaces
range: float
multivalued: true
unit:
ucum_code: J/m2