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jij-prediction-model-selection.org 2.71 KiB
Model Citation Type CSSP NN Defects Spin Symmetry
AutoML \cite{conradBenchmarkingAutoMLRegression2022} Composition X - -
Coulomb matrix \cite{ruppFastAccurateModeling2012} Descriptor - explicit
SOAP \cite{bartokRepresentingChemicalEnvironments2013a} Descriptor - explicit
Alchemical SOAP \cite{lopanitsynaModelingHighentropyTransition2023} Potential X - explicit
Disordered SOAP \cite{sommer3DSCDatasetSuperconductors2023} Descriptor X - explicit
GAP \cite{bartokGaussianApproximationPotentials2010} Potential X ? explicit
ACE \cite{bochkarevEfficientParametrizationAtomic2022} Potential - explicit
MEGNetSparse \cite{kazeevSparseRepresentationMachine2023} Potential X X X - explicit
MACE \cite{batatiaMACEHigherOrder2022} Potential X X - explicit
MACE-MP \cite{batatiaFoundationModelAtomistic2023} UIP X X - explicit
Magnetic ACE \cite{rinaldiNoncollinearMagneticAtomic2024} Potential noco explicit
SpinGNN++ \cite{yuGeneralTimereversalEquivariant2024} Potential X X noco explicit
CHGNet \cite{dengCHGNetPretrainedUniversal2023a} UIP X X coll explicit
SNRep \cite{dominaSpectralNeighborRepresentation2022} Potential coll explicit
PET \cite{pozdnyakovSmoothExactRotational2024} Potential ? X coll approximate