Autonomous chemical reactions in scanning probe microscopy
Autooss Video of Autooss monitoring the STM Image dataset for four image classification models Dataset for Model_target Dataset for Model_ind Dataset for Model_diss Dataset for Model_triple optimized neural network parameters (.pth) Theoretical calculations (DFT and BOSS) Reaction trajectories of three reactions (first Br removal, second Br removal and two Br removal concurrently) Density of states for ZnBr2Me4DPP Orbitals Charge density difference (ZnBr2Me4DPP, ZnBrMe4DPP and Me4DPP on Au(111) BOSS for phenyl group andm methyl group BOSS for configurations of ZnBr2Me4DPP
Institutions
- Universidad Autónoma de Madrid (ES)
- Swiss Federal Laboratories for Materials Science and Technology (CH)
- Aalto University (FI)
Publication Details
- Journal
- Zenodo (CERN European Organization for Nuclear Research)
- Published
- 2024-09-09
- DOI
- https://doi.org/10.5281/zenodo.13735006
- Primary Topic
- Machine Learning in Materials Science
- Type
- article
- Field-Weighted Citation Impact
- 0.00