Slot: smearing_broadening
Gaussian or Lorentzian broadening applied to the simulated spectrum.
URI: coremeta4cat:smearing_broadening Alias: smearing_broadening
Applicable Classes
| Name | Description | Modifies Slot |
|---|---|---|
| BandGap | Electronic band gap and its character (direct/indirect), with optional many-body (GW) or excitonic corrections. Critical for photocatalyst and semiconductor catalyst screening. |
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:smearing_broadening |
| native | coremeta4cat:smearing_broadening |
LinkML Source
name: smearing_broadening
description: Gaussian or Lorentzian broadening applied to the simulated spectrum.
from_schema: https://w3id.org/nfdi4cat/coremeta4cat
rank: 1000
slot_uri: coremeta4cat:smearing_broadening
alias: smearing_broadening
domain_of:
- BandGap
range: float
multivalued: true
unit:
ucum_code: eV