Statements (26)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
gptkb:software
|
| gptkbp:citation |
A. Rocca, D. Gebauer, Y. Saad, S. Baroni, J. Chem. Phys. 128, 154105 (2008)
|
| gptkbp:developedBy |
gptkb:Quantum_ESPRESSO_community
|
| gptkbp:feature |
parallel computing support
electron energy loss spectra finite electric field response linear response TDDFT optical absorption spectra |
| gptkbp:format |
text files
Quantum ESPRESSO input files |
| https://www.w3.org/2000/01/rdf-schema#label |
TurboTDDFT
|
| gptkbp:latestReleaseVersion |
as part of Quantum ESPRESSO releases
|
| gptkbp:license |
gptkb:GNU_General_Public_License
|
| gptkbp:partOf |
gptkb:Quantum_ESPRESSO_suite
|
| gptkbp:platform |
gptkb:macOS
gptkb:Unix gptkb:Linux |
| gptkbp:supports |
pseudopotentials
plane-wave basis sets |
| gptkbp:usedFor |
time-dependent density functional theory calculations
excited-state properties optical spectra |
| gptkbp:website |
https://www.quantum-espresso.org/
|
| gptkbp:writtenBy |
gptkb:Fortran
|
| gptkbp:bfsParent |
gptkb:Quantum_ESPRESSO
|
| gptkbp:bfsLayer |
6
|