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Prediction of High-Valent Iron K-edge Absorption Spectra by Time-Dependent Density Functional Theory
In recent years a number of high-valent iron intermediates have been identified as reactive species in iron-containing metalloproteins. Inspired by the interest in these highly reactive species, chemists have synthesized Fe(IV) and Fe(V) model complexes with terminal oxo or nitrido groups, as well a...
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| Main Authors: | , , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
2011
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3242413/ https://ncbi.nlm.nih.gov/pubmed/21956429 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c1dt11331c |
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