Statements (36)
| Predicate | Object |
|---|---|
| gptkbp:instanceOf |
computational chemistry software
|
| gptkbp:application |
quantum chemistry
molecular modeling |
| gptkbp:citation |
M. J. Frisch et al., Gaussian 09, Revision A.1, Gaussian, Inc., Wallingford CT, 2009.
|
| gptkbp:developer |
gptkb:Gaussian,_Inc.
|
| gptkbp:feature |
gptkb:density_functional_theory
molecular mechanics geometry optimization transition state search semi-empirical methods ab initio calculations NMR chemical shift prediction UV/Vis spectra prediction solvent effects modeling thermochemistry calculations vibrational frequency analysis |
| gptkbp:format |
Gaussian input file
Gaussian output file |
| https://www.w3.org/2000/01/rdf-schema#label |
Gaussian 09
|
| gptkbp:license |
proprietary
|
| gptkbp:operatingSystem |
gptkb:Windows
gptkb:macOS gptkb:Linux |
| gptkbp:predecessor |
Gaussian 03
|
| gptkbp:programmingLanguage |
gptkb:Fortran
|
| gptkbp:releaseYear |
2009
|
| gptkbp:successor |
gptkb:Gaussian_16
|
| gptkbp:usedBy |
chemists
materials scientists pharmaceutical researchers |
| gptkbp:website |
https://gaussian.com/g09/
|
| gptkbp:bfsParent |
gptkb:Gaussian,_Inc.
gptkb:Gaussian_16 gptkb:Gaussian_16,_Revision_C.01,_M._J._Frisch_et_al. gptkb:Michael_J._Frisch |
| gptkbp:bfsLayer |
7
|