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Simulation of surface processes
Computer simulations of surface processes can reveal unexpected insight regarding atomic-scale structure and transitions. Here, the strengths and weaknesses of some commonly used approaches are reviewed as well as promising avenues for improvements. The electronic degrees of freedom are usually desc...
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
National Academy of Sciences
2011
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| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3024682/ https://ncbi.nlm.nih.gov/pubmed/21199939 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1006670108 |
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