supportsCalculation
P187024
predicate
Indicates that one entity provides the capability or functionality for another entity to perform a specific calculation or set of calculations.
Observed surface forms (2)
| Surface form | Occurrences |
|---|---|
| supportsCalculationType | 5 |
| usesCalculationEngine | 1 |
Sample triples (29)
| Subject | Object |
|---|---|
| Gaussian | geometry optimization ⓘ |
| Gaussian | vibrational frequency analysis ⓘ |
| Gaussian | transition state search ⓘ |
| Gaussian | molecular properties ⓘ |
| Gaussian | excited states ⓘ |
| ABINIT | ground-state electronic structure ⓘ |
| ABINIT | total energy ⓘ |
| ABINIT | forces ⓘ |
| ABINIT | stresses ⓘ |
| ABINIT | geometry optimization ⓘ |
| ABINIT | phonon properties ⓘ |
| ABINIT | vibrational properties ⓘ |
| ABINIT | elastic properties ⓘ |
| ABINIT | optical properties ⓘ |
| ABINIT | response functions ⓘ |
| ABINIT | band structure ⓘ |
| ABINIT | density of states ⓘ |
| ABINIT | molecular dynamics ⓘ |
| ABINIT | finite electric field properties ⓘ |
| ABINIT | polarization ⓘ |
| ABINIT | dielectric properties ⓘ |
| ABINIT | piezoelectric properties ⓘ |
| ABINIT | nonlinear optical properties ⓘ |
| SIESTA | ground-state electronic structure calculations via predicate surface "supportsCalculationType" ⓘ |
| SIESTA | geometry optimization via predicate surface "supportsCalculationType" ⓘ |
| SIESTA | molecular dynamics via predicate surface "supportsCalculationType" ⓘ |
| SIESTA | band structure calculations via predicate surface "supportsCalculationType" ⓘ |
| SIESTA | density of states calculations via predicate surface "supportsCalculationType" ⓘ |
| Microsoft Excel 2003 | Excel 2003 calculation engine via predicate surface "usesCalculationEngine" NERFINISHED ⓘ |