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Electronic structure of aqueous solutions: Bridging the gap between theory and experiments
Predicting the electronic properties of aqueous liquids has been a long-standing challenge for quantum mechanical methods. However, it is a crucial step in understanding and predicting the key role played by aqueous solutions and electrolytes in a wide variety of emerging energy and environmental te...
Autores principales: | Pham, Tuan Anh, Govoni, Marco, Seidel, Robert, Bradforth, Stephen E., Schwegler, Eric, Galli, Giulia |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Association for the Advancement of Science
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5482551/ https://www.ncbi.nlm.nih.gov/pubmed/28691091 http://dx.doi.org/10.1126/sciadv.1603210 |
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