Partnering dispersion corrections with modern parameter-free double-hybrid density functionals
2017 ◽
Vol 19
(21)
◽
pp. 13481-13487
◽
The PBE-QIDH and SOS1-PBE-QIDH double-hybrid density functionals are merged with a pair of dispersion corrections, namely the pairwise additive D3(BJ) and the non-local correlation functional VV10, leading to the corresponding dispersion-corrected models.
Keyword(s):
2006 ◽
Vol 8
(38)
◽
pp. 4398
◽
Keyword(s):
1993 ◽
Vol 205
(4-5)
◽
pp. 348-353
◽
Keyword(s):
Keyword(s):
Keyword(s):
Keyword(s):