| Title | Neural networks vs Gaussian process regression for representing potential energy surfaces: A comparative study of fit quality and vibrational spectrum accuracy |
| Publication Type | Journal Article |
| Year of Publication | 2018 |
| Authors | Kamath, A, Vargas-Hernández, RA, Krems, RV, Carrington, T, Manzhos, S |
| Journal | J. Chem. Phys. |
| Volume | 148 |
| Pagination | 241702 |
| URL | https://doi.org/10.1063/1.5003074 |
| DOI | 10.1063/1.5003074 |
