Slot: total_energy_per_atom
Total energy per atom
URI: catcore:total_energy_per_atom Alias: total_energy_per_atom
Applicable Classes
| Name | Description | Modifies Slot |
|---|---|---|
| DFT | Density functional theory | no |
Properties
-
Range: Float
-
Multivalued: True
Identifier and Mapping Information
Schema Source
- from schema: https://w3id.org/nfdi4cat/catcore
Mappings
| Mapping Type | Mapped Value |
|---|---|
| self | catcore:total_energy_per_atom |
| native | catcore:total_energy_per_atom |
LinkML Source
name: total_energy_per_atom
description: Total energy per atom
from_schema: https://w3id.org/nfdi4cat/catcore
rank: 1000
slot_uri: catcore:total_energy_per_atom
alias: total_energy_per_atom
domain_of:
- DFT
range: float
multivalued: true
unit:
ucum_code: eV