John M. Herbert
Affiliations: | Chemistry and Biochemistry | Ohio State University, Columbus, Columbus, OH |
Area:
Electronic structure theory and molecular quantum mechanicsWebsite:
http://chemistry.osu.edu/faculty/herbertGoogle:
"John M. Herbert"Bio:
http://chemistry.osu.edu/~herbert/
http://chemistry.osu.edu/~herbert/bio.html
Mean distance: 8.51 | S | N | B | C | P |
Parents
Sign in to add mentorJohn Edward Harriman | grad student | 2003 | UW Madison | |
(Reconstructive approaches to one-and two-electron density matrix theory) | ||||
Anne B. McCoy | post-doc | Ohio State | ||
Martin Head-Gordon | post-doc | 2006 | UC Berkeley |
Children
Sign in to add traineeAdrian W. Lange | grad student | 2012 | Ohio State |
Ryan M. Richard | grad student | 2013 | Ohio State |
Xing Zhang | grad student | 2011-2016 |
Collaborators
Sign in to add collaboratorJoseph Vincent Ortiz | collaborator | 1999-2000 | Kansas State University |
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Publications
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Broderick DR, Herbert JM. (2023) Scalable generalized screening for high-order terms in the many-body expansion: Algorithm, open-source implementation, and demonstration. The Journal of Chemical Physics. 159 |
Jana S, Herbert JM. (2023) Correction to "Fractional-Electron and Transition-Potential Methods for Core-to-Valence Excitation Energies Using Density Functional Theory". Journal of Chemical Theory and Computation. 19: 7432-7433 |
Jana S, Herbert JM. (2023) Fractional-Electron and Transition-Potential Methods for Core-to-Valence Excitation Energies Using Density Functional Theory. Journal of Chemical Theory and Computation |
Jana S, Herbert JM. (2023) Slater transition methods for core-level electron binding energies. The Journal of Chemical Physics. 158: 094111 |
Herbert JM, Head-Gordon M, Hratchian HP, et al. (2022) Words Matter: On the Debate over Free Speech, Inclusivity, and Academic Excellence. The Journal of Physical Chemistry Letters. 13: 7100-7104 |
Alam B, Jiang H, Zimmerman PM, et al. (2022) State-specific solvation for restricted active space spin-flip (RAS-SF) wave functions based on the polarizable continuum formalism. The Journal of Chemical Physics. 156: 194110 |
Zhang X, Herbert JM. (2021) Nonadiabatic dynamics with spin-flip vs linear-response time-dependent density functional theory: A case study for the protonated Schiff base CHNH. The Journal of Chemical Physics. 155: 124111 |
Carter-Fenk K, Lao KU, Herbert JM. (2021) Predicting and Understanding Non-Covalent Interactions Using Novel Forms of Symmetry-Adapted Perturbation Theory. Accounts of Chemical Research |
Epifanovsky E, Gilbert ATB, Feng X, et al. (2021) Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package. The Journal of Chemical Physics. 155: 084801 |
Aksu H, Paul SK, Herbert JM, et al. (2020) How Well Does a Solvated Octa-acid Capsule Shield the Embedded Chromophore? A Computational Analysis Based on an Anisotropic Dielectric Continuum Model. The Journal of Physical Chemistry. B. 124: 6998-7004 |