Comparison of large basis set DFT and MP2 calculations in...

Comparison of large basis set DFT and MP2 calculations in the study of the barrier for internal rotation of 2,3,5,6-tetrafluoroanisole

Martina Kieninger, Raúl E. Cachau, Heinz Oberhammer, Oscar N. Ventura
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Volume:
107
Year:
2007
Language:
english
Pages:
15
DOI:
10.1002/qua.21071
File:
PDF, 553 KB
english, 2007
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