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2403.06955
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Accurate Crystal Structure Prediction of New 2D Hybrid Organic Inorganic Perovskites
11 March 2024
Nima Karimitari
William J. Baldwin
Evan W. Muller
Zachary J. L. Bare
W. J. Kennedy
Gábor Csányi
Christopher Sutton
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Papers citing
"Accurate Crystal Structure Prediction of New 2D Hybrid Organic Inorganic Perovskites"
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Title
Hyperactive Learning (HAL) for Data-Driven Interatomic Potentials
Cas van der Oord
Matthias Sachs
D. P. Kovács
Christoph Ortner
Gábor Csányi
51
64
0
09 Oct 2022
E(3)-Equivariant Graph Neural Networks for Data-Efficient and Accurate Interatomic Potentials
Simon L. Batzner
Albert Musaelian
Lixin Sun
Mario Geiger
J. Mailoa
M. Kornbluth
N. Molinari
Tess E. Smidt
Boris Kozinsky
254
1,241
0
08 Jan 2021
1