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John M Herbert

63PUBLICATIONS

46CO-AUTHORS

Theoretical quantum chemistryComputational chemistryElectronic and magnetic properties of condensed matter; superconductivityRadiation and matterSpatial data and applications

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Publications (63)

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|May 04, 2026

Benchmark assessment of collinear, mixed-reference, and spin-adapted variants of spin-flip time-dependent density functional theory, for closed- and open-shell molecules.

|Mar 30, 2026

Energy-Screened Many-Body Expansion for Protein-Ligand Interactions: Examining Convergence for Metalloenzymes Through Seven-Body Interactions.

Paige E Bowling, Dustin R Broderick, John M Herbert

|Nov 19, 2025

Extended Configuration-Interaction Singles Method with Core/Valence Separation (XCIS-CVS): Core-Level Spectra of Open-Shell Molecules.

Avik Kumar Ojha, John M Herbert

|Jul 21, 2025

Computing L- and M-edge spectra using the DFT/CIS method with spin-orbit coupling.

Aniket Mandal, John M Herbert

|Apr 21, 2025

Revisiting the Half-and-Half Functional.

Montgomery Gray, Aniket Mandal, John M Herbert

|Mar 07, 2025

Untangling Sources of Error in the Density-Functional Many-Body Expansion.

Dustin R Broderick, John M Herbert

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Frequent Collaborators

9 joint publications

Kevin Carter-Fenk

5 joint publications

Aniket Mandal

4 joint publications

Ka Un Lao

4 joint publications

Bhaskar Rana

4 joint publications

Saswata Dasgupta

3 joint publications

Dustin R Broderick

3 joint publications

Christopher J Mundy

3 joint publications

Avik Kumar Ojha

3 joint publications

Marc P Coons

2 joint publications

Kuan-Yu Liu

Frequent Collaborators

9 joint publications

Kevin Carter-Fenk

5 joint publications

Aniket Mandal

4 joint publications

Ka Un Lao

4 joint publications

Bhaskar Rana

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