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Nuclear quantum effects and hydrogen bond fluctuations in water
The hydrogen bond (HB) is central to our understanding of the properties of water. However, despite intense theoretical and experimental study, it continues to hold some surprises. Here, we show from an analysis of ab initio simulations that take proper account of nuclear quantum effects that the hy...
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| Huvudupphovsmän: | , , , |
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| Materialtyp: | Artigo |
| Språk: | Inglês |
| Publicerad: |
National Academy of Sciences
2013
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| Ämnen: | |
| Länkar: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3785726/ https://ncbi.nlm.nih.gov/pubmed/24014589 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.1308560110 |
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