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Nadezhda N. Nikitina,Daria A. Pichugina,Alexander V. Oleynichenko,Oxana N. Ryzhova,Kirill E. Kopylov,Vladimir V. Krotov,Nikolay E. Kuz?menko
Pág. 83 - 88
High-level procedures (MP2, CCSD, CCSD(T)) and reliable experimental data have been used to assess the performance of a variety of exchange-correlation functionals for the calculation of structures and energies of small models of thiolate-protected gold ...
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