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Peverati, Roberto, Head-Gordon, Martin (2013) Orbital optimized double-hybrid density functionals. The Journal of Chemical Physics, 139 (2). 24110pp. doi:10.1063/1.4812689

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Reference TypeJournal (article/letter/editorial)
TitleOrbital optimized double-hybrid density functionals
JournalThe Journal of Chemical Physics
AuthorsPeverati, RobertoAuthor
Head-Gordon, MartinAuthor
Year2013 (July 14)Volume139
Issue2
PublisherAIP Publishing
DOIdoi:10.1063/1.4812689Search in ResearchGate
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Mindat Ref. ID2364140Long-form Identifiermindat:1:5:2364140:2
GUID0
Full ReferencePeverati, Roberto, Head-Gordon, Martin (2013) Orbital optimized double-hybrid density functionals. The Journal of Chemical Physics, 139 (2). 24110pp. doi:10.1063/1.4812689
Plain TextPeverati, Roberto, Head-Gordon, Martin (2013) Orbital optimized double-hybrid density functionals. The Journal of Chemical Physics, 139 (2). 24110pp. doi:10.1063/1.4812689
In(2013, July) The Journal of Chemical Physics Vol. 139 (2) AIP Publishing

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Chai, Jeng-Da, Head-Gordon, Martin (2009) Long-range corrected double-hybrid density functionals. The Journal of Chemical Physics, 131 (17). 174105pp. doi:10.1063/1.3244209
Stück, David, Head-Gordon, Martin (2013) Regularized orbital-optimized second-order perturbation theory. The Journal of Chemical Physics, 139 (24). 244109pp. doi:10.1063/1.4851816
Chai, Jeng-Da, Head-Gordon, Martin (2008) Systematic optimization of long-range corrected hybrid density functionals. The Journal of Chemical Physics, 128 (8). 84106pp. doi:10.1063/1.2834918
Mardirossian, Narbe, Head-Gordon, Martin (2014) Exploring the limit of accuracy for density functionals based on the generalized gradient approximation: Local, global hybrid, and range-separated hybrid functionals with and without dispersion corrections. The Journal of Chemical Physics, 140 (18). 18pp. doi:10.1063/1.4868117
Mardirossian, Narbe, Head-Gordon, Martin (2016) ωB97M-V: A combinatorially optimized, range-separated hybrid, meta-GGA density functional with VV10 nonlocal correlation. The Journal of Chemical Physics, 144 (21). 214110pp. doi:10.1063/1.4952647
Mardirossian, Narbe, Head-Gordon, Martin (2018) Survival of the most transferable at the top of Jacob’s ladder: Defining and testing the ωB97M(2) double hybrid density functional. The Journal of Chemical Physics, 148 (24). 241736pp. doi:10.1063/1.5025226
Peverati, Roberto, Truhlar, Donald G. (2011) Improving the Accuracy of Hybrid Meta-GGA Density Functionals by Range Separation. The Journal of Physical Chemistry Letters, 2 (21). 2810-2817 doi:10.1021/jz201170d
Sokolov, Alexander Yu., Schaefer, Henry F. (2013) Orbital-optimized density cumulant functional theory. The Journal of Chemical Physics, 139 (20). 204110pp. doi:10.1063/1.4833138
Chai, Jeng-Da, Head-Gordon, Martin (2008) Long-range corrected hybrid density functionals with damped atom–atom dispersion corrections. Physical Chemistry Chemical Physics, 10 (44). 6615pp. doi:10.1039/b810189b
Mardirossian, Narbe, Head-Gordon, Martin (2015) Mapping the genome of meta-generalized gradient approximation density functionals: The search for B97M-V. The Journal of Chemical Physics, 142 (7). 74111pp. doi:10.1063/1.4907719
Chai, Jeng-Da, Head-Gordon, Martin (2008) Optimal operators for Hartree–Fock exchange from long-range corrected hybrid density functionals. Chemical Physics Letters, 467. 176-178 doi:10.1016/j.cplett.2008.10.070
 
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