Massively parallel fitting of Gaussian approximation potentials.
Sascha KlawohnJames R. KermodeAlbert P. BartókPublished in: Mach. Learn. Sci. Technol. (2023)
Keyphrases
- massively parallel
- gaussian convolution
- fine grained
- linear computational complexity
- parallel computing
- series expansion
- high performance computing
- parallel machines
- parallel computers
- maximum likelihood
- parallel programming
- parallel architectures
- taylor series expansion
- blue gene
- mesh connected
- search algorithm
- information systems