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H Energetics on Charged Graphene
14 ResourcesMigration energy barriers, adsorption and desorption energies, and density of states data for hydrogen adsorbing on charged graphene, as calculated using density functional theory. -
Computational Prediction of Hydrogen Storage Capacities in MOFs
5 ResourcesThis dataset includes calculated crystallographic properties and usable hydrogen storage capacities for a database of MOFs. The capacities are reported for pressure swing... -
Demo: MgB2 and B203 Simulation Data versus experimental MgB2 Multi-Spectra Da...
4 ResourcesThe Advanced Multi-spectra data view parses many columns from the same csv and parses many csv resources. To set up the view, add Multi-spectra Data Tool metadata to each... -
Machine Learning Ready Metal Hydrides
2 ResourcesAn open question in the metal hydride community is whether there are simple, physics-based design rules that dictate the thermodynamic properties of these materials across the...
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