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Equivariant representations for molecular Hamiltonians and N-center atomic-scale properties

Equivariant representations for molecular Hamiltonians and N-center atomic-scale properties

Jigyasa Nigam
M. J. Willatt
Michele Ceriotti
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Papers citing "Equivariant representations for molecular Hamiltonians and N-center atomic-scale properties"

2 / 2 papers shown
Title
Learning local equivariant representations for quantum operators
Learning local equivariant representations for quantum operators
Zhanghao Zhouyin
Zixi Gan
MingKang Liu
S. K. Pandey
Linfeng Zhang
Qiangqiang Gu
120
3
0
28 Jan 2025
Machine learning Hubbard parameters with equivariant neural networks
Machine learning Hubbard parameters with equivariant neural networks
M. Uhrin
A. Zadoks
Luca Binci
Nicola Marzari
I. Timrov
50
6
0
04 Jun 2024