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Photoabsorption markers of pressure-induced phase changes in small mercury clusters. A case study on Hg(8)
Photoabsorption spectra of Hg(8) have been calculated at various cluster temperatures and external pressures. A diatomics-in-molecules method has been used to model cluster electronic structure and classical isothermal–isobaric Monte Carlo simulations have been employed for sampling representative c...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2019
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9075602/ https://www.ncbi.nlm.nih.gov/pubmed/35542259 http://dx.doi.org/10.1039/c9ra08000g |