Error Accumulations in Adhesive Energies of Dihydrogen Molecular Chains: Performances of the XYG3 Type of Doubly Hybrid Density Functionals
Su, Neil Qiang, Xu, XinVolume:
119
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp507711t
Date:
March, 2015
File:
PDF, 2.87 MB
english, 2015