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Is There Still Room for Parameter Free Double Hybrids? Performances of PBE0-DH and B2PLYP over Extended Benchmark Sets
Bousquet, Diane, Brémond, Eric, Sancho-García, Juan C., Ciofini, Ilaria, Adamo, CarloVolume:
9
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct400358f
Date:
August, 2013
File:
PDF, 559 KB
english, 2013