Hunting for hydrogen: random structure searching and prediction of NMR parameters of hydrous wadsleyite

Robert F. Moran, David McKay, Chris J. Pickard, Andrew J. Berry, John M. Griffin, Sharon E. Ashbrook
  • Physical Chemistry Chemical Physics, January 2016, Royal Society of Chemistry
  • DOI: 10.1039/c6cp01529h

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http://dx.doi.org/10.1039/c6cp01529h

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