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The accuracy of current density functionals for the calculation of electric field gradients: A comparison with ab initio methods for HCl and CuCl
Schwerdtfeger, Peter, Pernpointner, Markus, Laerdahl, Jon K.Volume:
111
Year:
1999
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.479620
File:
PDF, 334 KB
english, 1999