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Validation of the density-functional based tight-binding approximation method for the calculation of reaction energies and other data
Krüger, Thomas, Elstner, Marcus, Schiffels, Peter, Frauenheim, ThomasVolume:
122
Year:
2005
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.1871913
File:
PDF, 371 KB
english, 2005