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Breakdown of the pseudopotential approximation for magnetizabilities and electric multipole moments: Test calculations for Au, AuF, and Snn cluster (n ≤ 20)
Schwerdtfeger, Peter, Assadollahzadeh, Behnam, Rohrmann, Urban, Schäfer, Rolf, Cheeseman, James R.Volume:
134
Year:
2011
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.3591338
File:
PDF, 266 KB
english, 2011