Scaling exchange and correlation in the on-top density functional of multiconfiguration pair-density functional theory: effect on electronic excitation energies and bond energies-Reference-Cited by-同舟云学术

Scaling exchange and correlation in the on-top density functional of multiconfiguration pair-density functional theory: effect on electronic excitation energies and bond energies

Published:2020-01-23 Issue:2 Volume:139 Page:
ISSN:1432-881X
Container-title:Theoretical Chemistry Accounts
language:en
Short-container-title:Theor Chem Acc

Author:

Presti Davide^ORCID,Kadlec Jan^ORCID,Truhlar Donald G.^ORCID,Gagliardi Laura^ORCID

Funder

National Science Foundation

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry

Link

http://link.springer.com/content/pdf/10.1007/s00214-019-2539-6.pdf

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4. Presti D, Pedone A, Ciofini I et al (2016) Optical properties of the dibenzothiazolylphenol molecular crystals through ONIOM calculations: the effect of the electrostatic embedding scheme. Theor Chem Acc. https://doi.org/10.1007/s00214-016-1808-x

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