Articles with public access mandates - Janosh RiebesellLearn more
Available somewhere: 4
CHGNet as a pretrained universal neural network potential for charge-informed atomistic modelling
B Deng, P Zhong, KJ Jun, J Riebesell, K Han, CJ Bartel, G Ceder
Nature Machine Intelligence 5 (9), 1031-1041, 2023
Mandates: US National Science Foundation, US Department of Energy
Jobflow: Computational workflows made simple
AS Rosen, M Gallant, J George, J Riebesell, H Sahasrabuddhe, JX Shen, ...
Journal of Open Source Software 9 (93), 5995, 2024
Mandates: US Department of Energy, UK Engineering and Physical Sciences Research …
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange
ML Evans, J Bergsma, A Merkys, CW Andersen, OB Andersson, D Beltrán, ...
Digital Discovery 3 (8), 1509-1533, 2024
Mandates: Swiss National Science Foundation, Swedish Research Council, UK Engineering …
Atomate2: Modular workflows for materials science
A Ganose, H Sahasrabuddhe, M Asta, K Beck, T Biswas, A Bonkowski, ...
ChemRxiv, 1-66, 2025
Mandates: UK Engineering and Physical Sciences Research Council, European Commission
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