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Accurate frozen-density embedding potentials as a first step towards a subsystem description of covalent bonds
Fux, Samuel, Jacob, Christoph R., Neugebauer, Johannes, Visscher, Lucas, Reiher, MarkusVolume:
132
Year:
2010
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.3376251
File:
PDF, 754 KB
english, 2010