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The CECAM electronic structure library and the modular software development paradigm.
Oliveira MJT, Papior N, Pouillon Y, Blum V, Artacho E, Caliste D, Corsetti F, de Gironcoli S, Elena AM, García A, García-Suárez VM, Genovese L, Huhn WP, Huhs G, Kokott S, Küçükbenli E, Larsen AH, Lazzaro A, Lebedeva IV, Li Y, López-Durán D, López-Tarifa P, Lüders M, Marques MAL, Minar J, Mohr S, Mostofi AA, O'Cais A, Payne MC, Ruh T, Smith DGA, Soler JM, Strubbe DA, Tancogne-Dejean N, Tildesley D, Torrent M, Yu VW. Oliveira MJT, et al. Among authors: huhn wp. J Chem Phys. 2020 Jul 14;153(2):024117. doi: 10.1063/5.0012901. J Chem Phys. 2020. PMID: 32668924
The Elephant in the Room of Density Functional Theory Calculations.
Jensen SR, Saha S, Flores-Livas JA, Huhn W, Blum V, Goedecker S, Frediani L. Jensen SR, et al. Among authors: huhn w. J Phys Chem Lett. 2017 Apr 6;8(7):1449-1457. doi: 10.1021/acs.jpclett.7b00255. Epub 2017 Mar 20. J Phys Chem Lett. 2017. PMID: 28291362
Channelrhodopsin-2, a directly light-gated cation-selective membrane channel.
Nagel G, Szellas T, Huhn W, Kateriya S, Adeishvili N, Berthold P, Ollig D, Hegemann P, Bamberg E. Nagel G, et al. Among authors: huhn w. Proc Natl Acad Sci U S A. 2003 Nov 25;100(24):13940-5. doi: 10.1073/pnas.1936192100. Epub 2003 Nov 13. Proc Natl Acad Sci U S A. 2003. PMID: 14615590 Free PMC article.
34 results