ELECTRA: A Cartesian Network for 3D Charge Density Prediction with Floating Orbitals

Item #:

085713-0947

Details

DOI: https://doi.org/10.52202/085713-0947
Author(s): Jonas Elsborg, Luca Thiede, Alan Aspuru-Guzik, Tejs Vegge, Arghya Bhowmik
Pages: 31897-31926 (30 pages)
Format: PDF Paper Download
Conference: Advances in Neural Information Processing Systems 38
Date/Location: Held 2-7 December 2025, San Diego, California, USA and 30 November - 5 December 2025, Mexico City, Mexico.
Series: Advances in Neural Information Processing Systems 38
Publisher: Neural Information Processing Systems Foundation, Inc. (NeurIPS)

DOI: https://doi.org/10.52202/085713-0947
Author(s): Jonas Elsborg, Luca Thiede, Alan Aspuru-Guzik, Tejs Vegge, Arghya Bhowmik
Pages: 31897-31926 (30 pages)
Format: PDF Paper Download
Conference: Advances in Neural Information Processing Systems 38
Date/Location: Held 2-7 December 2025, San Diego, California, USA and 30 November - 5 December 2025, Mexico City, Mexico.
Series: Advances in Neural Information Processing Systems 38
Publisher: Neural Information Processing Systems Foundation, Inc. (NeurIPS)