Slot: excitonic_correction
Excitonic correction (from Bethe-Salpeter equation) applied to the
optical band gap.
URI: coremeta4cat:excitonic_correction Alias: excitonic_correction
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:excitonic_correction |
| native | coremeta4cat:excitonic_correction |
LinkML Source
name: excitonic_correction
description: 'Excitonic correction (from Bethe-Salpeter equation) applied to the
optical band gap.'
from_schema: https://w3id.org/nfdi4cat/coremeta4cat
rank: 1000
slot_uri: coremeta4cat:excitonic_correction
alias: excitonic_correction
domain_of:
- BandGap
range: float
multivalued: true
unit:
ucum_code: eV