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Exploration of H 2 binding to the [NiFe]-hydrogenase active site with multiconfigurational density functional theory
Dong, Geng, Ryde, Ulf, Aa. Jensen, Hans Jørgen, Hedegård, Erik D.Year:
2017
Language:
english
Journal:
Physical Chemistry Chemical Physics
DOI:
10.1039/c7cp06767d
File:
PDF, 2.13 MB
english, 2017