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Proton transfer in imidazole-based molecular crystals.
Iannuzzi M. Iannuzzi M. J Chem Phys. 2006 May 28;124(20):204710. doi: 10.1063/1.2202323. J Chem Phys. 2006. PMID: 16774367 Free article.
In this work, we report in detail the results of ab initio molecular dynamics calculations, which were briefly presented in a previous Letter [M. Iannuzzi and M. Parrinello, Phys. Rev. Lett. 93, 025901 (2004)]. The conformational changes associated with the d …
In this work, we report in detail the results of ab initio molecular dynamics calculations, which were briefly presented in a previous Lette …
Nano-ice on boron nitride nanomesh: accessing proton disorder.
Ma H, Brugger T, Berner S, Ding Y, Iannuzzi M, Hutter J, Osterwalder J, Greber T. Ma H, et al. Among authors: iannuzzi m. Chemphyschem. 2010 Feb 1;11(2):399-403. doi: 10.1002/cphc.200900857. Chemphyschem. 2010. PMID: 20024977
272 results