DFT Calculations of Structure and IR Spectra of M@C<sub>60</sub> and M<sub>2</sub>@C<sub>60</sub> Endofullerenes (M=Sc and Y)
The endohedral metallofullerenes with a rare-earth metal encapsulated into the carbon cage are nanoparticles with potentially wide applications. We present the results of our quantum-chemical modelling of Sc@<inline-formula><math xmlns="http://www.w3.org/1998/Math/MathML" display="inline"><semantics...
I tiakina i:
| Ngā kaituhi matua: | , , , |
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| Hōputu: | Artigo |
| Reo: | Inglês |
| I whakaputaina: |
MDPI AG
2025-08-01
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| Rangatū: | Molecules |
| Ngā marau: | |
| Urunga tuihono: | https://www.mdpi.com/1420-3049/30/16/3421 |
| Ngā Tūtohu: |
Kāore He Tūtohu, Me noho koe te mea tuatahi ki te tūtohu i tēnei pūkete!
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