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Quantum crystallographic charge density of urea
Standard X-ray crystallography methods use free-atom models to calculate mean unit-cell charge densities. Real molecules, however, have shared charge that is not captured accurately using free-atom models. To address this limitation, a charge density model of crystalline urea was calculated using hi...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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International Union of Crystallography
2016
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4937779/ https://www.ncbi.nlm.nih.gov/pubmed/27437111 http://dx.doi.org/10.1107/S2052252516006242 |