Dr David Santos Carballal
Research Datasets
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- DFT+U Study of the electronic, magnetic and mechanical properties of Co, CoO, and Co3O4 - Cadi-Essadek A, Roldan A, Santos-Carballal A, et al. (2018). Cardiff University. 10.17035/d.2018.0061874165. Materials sciences Electronic Properties Magnetometry Mechanical Properties of Materials Microstructure analysis
- Ethylene carbonate adsorption on the major surfaces of lithium manganese oxide Li1-xMn2O4 spinel (0.000 < x < 0.375) - data - Ramogayana B, Santos Carballal D, Aparicio Sanchez P, et al. (2019). Cardiff University. 10.17035/d.2019.0085116020. Lithium-Ion batteries Computational chemistry Materials Sciences Catalyst Surface Reactivity
- Individual adsorption of arsenate and phosphate species on the magnetite Fe₃O₄(001) surface - data - Santos-Carballal D, de Leeuw NH (2021). Cardiff University. 10.17035/d.2019.0081529534. Computational chemistry Materials sciences
- Interaction of H2O with the platinum Pt (001), (011) and (111) surfaces: a density functional theory study with long-range dispersion corrections - data - Ungerer MJ, Santos-Carballal D, Cadi-Essadek A, et al. (2019). Cardiff University. 10.17035/d.2019.0068143277. Organometallic complexes Simulations Molecular interactions Data analysis Systems modelling
- Interaction of model natural organic matter with goethite α-FeO(OH) surfaces - Santos Carballal D, Du Z, King HE, et al. (2016). Cardiff University. 10.17035/d.2016.0008219810. Adsorption Surfaces and Interfaces Heterogeneous Reactions Materials sciences
