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Npj Computational Materials
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April 29, 2026
Equivariant electronic Hamiltonian prediction with many-body message passing
Chen Qian, Valdas Vitartas, James R Kermode, et al.
Digital Discovery
|
November 26, 2025
Active learning meets metadynamics: automated workflow for reactive machine learning interatomic potentials
Valdas Vitartas, Hanwen Zhang, Veronika Juraskova, et al.
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of 1
Search research articles
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Showing results (1-10 of 2) with videos related to
Sort By:
Page
of 1
Npj Computational Materials
|
April 29, 2026
Equivariant electronic Hamiltonian prediction with many-body message passing
Chen Qian, Valdas Vitartas, James R Kermode, et al.
Digital Discovery
|
November 26, 2025
Active learning meets metadynamics: automated workflow for reactive machine learning interatomic potentials
Valdas Vitartas, Hanwen Zhang, Veronika Juraskova, et al.
Page
of 1