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Magnetic and Structural Properties of Single 3d Transition Metals Adsorbed On Corannulene: A Density Functional Theory Study by Amit Chakraborty is a document available to read on EtoBox.
What is Magnetic and Structural Properties of Single 3d Transition Metals Adsorbed On Corannulene: A Density Functional Theory Study about?
This study investigates the magnetic properties of 3d transition metal atoms adsorbed on corannulene using density functional theory. It finds that most transition metals prefer binding on the convex surface, with specific stable sites identified for each metal, while all structures are magnetized except for the Ni-corannulene complex. The research highlights the potential of these metal-organic complexes for applications in spintronic devices.
- Author
- Amit Chakraborty
- Language
- EN