The Effect of the Basis-Set Superposition Error on the...

The Effect of the Basis-Set Superposition Error on the Calculation of Dispersion Interactions:  A Test Study on the Neon Dimer

Monari, Antonio, Bendazzoli, Gian Luigi, Evangelisti, Stefano, Angeli, Celestino, Ben Amor, Nadia, Borini, Stefano, Maynau, Daniel, Rossi, Elda
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Volume:
3
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct6003005
Date:
March, 2007
File:
PDF, 244 KB
english, 2007
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