@article{unifiedtheoryofatomcentered, title = {Unified theory of atom-centered representations and message-passing machine-learning schemes}, author = {Jigyasa Nigam and Sergey Pozdnyakov and Guillaume Fraux and Michele Ceriotti}, year = {2022}, eprint = {2202.01566}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2202.01566v3}, }