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Density Functional Theory

IRI

Preferred name Density Functional Theory

Type http://www.w3.org/2002/07/owl#Class

Status Active

Ontology ASMO

Definition

Density functional theory is a computational method used to study the electronic structure and ground state of atoms, molecules, and, solids. This technique determines the properties of a many-electron system through functionals of the spatially dependent electron density.

ID	http://purls.helmholtz-metadaten.de/asmo/DensityFunctionalTheory http://purls.helmholtz-metadaten.de/asmo/DensityFunctionalTheory https://dev.matportal.org/ontologies/ASMO/DensityFunctionalTheory
Preferred name	Density Functional Theory
Synonyms	DFT
Definitions	Density functional theory is a computational method used to study the electronic structure and ground state of atoms, molecules, and, solids. This technique determines the properties of a many-electron system through functionals of the spatially dependent electron density.

rdf:type	http://www.w3.org/2002/07/owl#Class Loading
rdfs:subClassOf	http://purls.helmholtz-metadaten.de/asmo/ComputationalMethod Loading
rdfs:label	Density Functional Theory
obo_purl:IAO_0000115	Density functional theory is a computational method used to study the electronic structure and ground state of atoms, molecules, and, solids. This technique determines the properties of a many-electron system through functionals of the spatially dependent electron density.
skos:altLabel	DFT

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Atomistic Simulation Methods Ontology (ASMO) (ASMO)

Density Functional Theory

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