A co-trained multifidelity mixture-of-experts MLIP partitions simulations into high- and low-capacity regions, maintains exact energy conservation and bulk modulus alignment, and runs more than twice as fast as a single high-fidelity model on a Pt+CO system.
Graph atomic cluster expansion for semilocal interactions beyond equivariant message passing.Physical Review X, 14(2):021036
3 Pith papers cite this work. Polarity classification is still indexing.
3
Pith papers citing it
citation-role summary
background 1
citation-polarity summary
years
2026 3verdicts
UNVERDICTED 3roles
background 1polarities
background 1representative citing papers
CrystalREPA closes the representation gap between crystal generators and universal MLIPs via contrastive alignment, yielding more stable and valid generated crystals while revealing that MLIP teacher quality is better predicted by representation distinguishability than by leaderboard accuracy.
An equivariant message-passing neural network embeds atomic spins explicitly to learn magnetic interactions, achieving near-DFT accuracy and data efficiency across magnetic systems via fine-tuning.
citing papers explorer
-
Mixture of Experts Framework in Machine Learning Interatomic Potentials for Atomistic Simulations
A co-trained multifidelity mixture-of-experts MLIP partitions simulations into high- and low-capacity regions, maintains exact energy conservation and bulk modulus alignment, and runs more than twice as fast as a single high-fidelity model on a Pt+CO system.
-
CrystalREPA: Transferring Physical Priors from Universal MLIPs to Crystal Generative Models
CrystalREPA closes the representation gap between crystal generators and universal MLIPs via contrastive alignment, yielding more stable and valid generated crystals while revealing that MLIP teacher quality is better predicted by representation distinguishability than by leaderboard accuracy.
-
Equivariant Many-body Message Passing Interatomic Potentials for Magnetic Materials
An equivariant message-passing neural network embeds atomic spins explicitly to learn magnetic interactions, achieving near-DFT accuracy and data efficiency across magnetic systems via fine-tuning.