Statements (18)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:database
|
| gptkbp:collaboratesWith |
gptkb:Argonne_National_Laboratory
gptkb:Northwestern_University |
| gptkbp:contains |
crystal structures
thermodynamic data first-principles calculations |
| gptkbp:field |
materials science
|
| gptkbp:focus |
computational materials discovery
|
| gptkbp:fullName |
gptkb:Open_Quantum_Materials_Database
|
| https://www.w3.org/2000/01/rdf-schema#label |
OQMD (collaborator)
|
| gptkbp:type |
density functional theory calculations
formation energies phase stability |
| gptkbp:usedFor |
high-throughput screening
materials design |
| gptkbp:website |
https://oqmd.org/
|
| gptkbp:bfsParent |
gptkb:Materials_Project
|
| gptkbp:bfsLayer |
7
|