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Casanova-Páez M, Goerigk L.Casanova-Páez M, et al. Among authors: goerigk l.J Chem Phys. 2020 Aug 14;153(6):064106. doi: 10.1063/5.0018354.J Chem Phys. 2020.PMID: 35287444
We continue our work on the long-range corrected double-hybrid density functionals (LC-DHDFs) omegaB2PLYP and omegaB2GP-PLYP that we developed in the context of time-dependent (TD) Density Functional Theory (DFT) to enable the robust description of singlet-singlet excitations [M. …
We continue our work on the long-range corrected double-hybrid density functionals (LC-DHDFs) omegaB2PLYP and omegaB2GP-PLYP that we develop …
Mehta N , Casanova-Páez M , Goerigk L .Mehta N , et al. Among authors: goerigk l.Phys Chem Chem Phys. 2018 Sep 19;20(36):23175-23194. doi: 10.1039/c8cp03852j.Phys Chem Chem Phys. 2018.PMID: 30062343
Casanova-Páez M, Dardis MB, Goerigk L.Casanova-Páez M, et al. Among authors: goerigk l.J Chem Theory Comput. 2019 Sep 10;15(9):4735-4744. doi: 10.1021/acs.jctc.9b00013. Epub 2019 Aug 8.J Chem Theory Comput. 2019.PMID: 31298850
Casanova-Páez M, Goerigk L.Casanova-Páez M, et al. Among authors: goerigk l.J Comput Chem. 2021 Mar 30;42(8):528-533. doi: 10.1002/jcc.26478. Epub 2021 Jan 7.J Comput Chem. 2021.PMID: 33415788
Bradley SJ , Chi M , White JM , Hall CR , Goerigk L , Smith TA , Ghiggino KP .Bradley SJ , et al. Among authors: goerigk l.Phys Chem Chem Phys. 2021 Apr 22;23(15):9357-9364. doi: 10.1039/d1cp00541c.Phys Chem Chem Phys. 2021.PMID: 33885111
Najibi A, Casanova-Páez M, Goerigk L.Najibi A, et al. Among authors: goerigk l.J Phys Chem A. 2021 May 13;125(18):4026-4035. doi: 10.1021/acs.jpca.1c02549. Epub 2021 May 2.J Phys Chem A. 2021.PMID: 33938224