Research Data Leeds Repository

First Principles Modelling of Organic-Inorganic Interfaces in Renal Calculi

Morris, Rhiannon (2023) First Principles Modelling of Organic-Inorganic Interfaces in Renal Calculi. University of Leeds. [Dataset] https://doi.org/10.5518/1385

Dataset description

This dataset holds video files which show the trajectories of AIMD simulations. Or alternatively, 3D representations in a rotating image of geometry optimisations.

Keywords:

Dataset, videos, trajectories

Divisions:

Faculty of Engineering and Physical Sciences > School of Food Science and Nutrition

License:

Creative Commons Attribution 4.0 International (CC BY 4.0)

Date deposited:

06 Oct 2023 09:52

URI:

http://archive.researchdata.leeds.ac.uk/id/eprint/1165