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The Journal of Chemical Physics
|
November 7, 2023
Optimizing the regularization in size-consistent second-order Brillouin-Wigner perturbation theory
Kevin Carter-Fenk, James Shee, Martin Head-Gordon
The Journal of Chemical Physics
|
July 22, 2019
Self-consistent charge embedding at very low cost, with application to symmetry-adapted perturbation theory
Kuan-Yu Liu, Kevin Carter-Fenk, John M Herbert
Accounts of Chemical Research
|
March 3, 2025
Correction to "Predicting and Understanding Noncovalent Interactions Using Novel Forms of Symmetry-Adapted Perturbation Theory"
Kevin Carter-Fenk, Ka Un Lao, John M Herbert
Journal of Chemical Theory and Computation
|
June 30, 2021
Natural Charge-Transfer Analysis: Eliminating Spurious Charge-Transfer States in Time-Dependent Density Functional Theory via Diabatization, with Application to Projection-Based Embedding
Kevin Carter-Fenk, Christopher J Mundy, John M Herbert
Accounts of Chemical Research
|
September 22, 2021
Predicting and Understanding Non-Covalent Interactions Using Novel Forms of Symmetry-Adapted Perturbation Theory
Kevin Carter-Fenk, Ka Un Lao, John M Herbert
Journal of Chemical Theory and Computation
|
April 22, 2026
The Dose Makes the Poison: Perturbative Steps toward the Ultimate Linearized Coupled Cluster Method
Sylvia J Bintrim, Ella R Ransford, Kevin Carter-Fenk
The Journal of Chemical Physics
|
June 1, 2022
Computing x-ray absorption spectra from linear-response particles atop optimized holes
Diptarka Hait, Katherine J Oosterbaan, Kevin Carter-Fenk, et al.
The Journal of Physical Chemistry Letters
|
May 8, 2019
Accurate and Efficient ab Initio Calculations for Supramolecular Complexes: Symmetry-Adapted Perturbation Theory with Many-Body Dispersion
Kevin Carter-Fenk, Ka Un Lao, Kuan-Yu Liu, et al.
The Journal of Physical Chemistry Letters
|
October 10, 2022
Electron-Affinity Time-Dependent Density Functional Theory: Formalism and Applications to Core-Excited States
Kevin Carter-Fenk, Leonardo A Cunha, Juan E Arias-Martinez, et al.
The Journal of Physical Chemistry Letters
|
April 27, 2023
Correction to "Birth of the Hydrated Electron via Charge-Transfer-to-Solvent Excitation of Aqueous Iodide"
Kevin Carter-Fenk, Britta A Johnson, John M Herbert, et al.
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of 3
Search research articles
Search
Showing results (11-20 of 29) with videos related to
Sort By:
Page
of 3
The Journal of Chemical Physics
|
November 7, 2023
Optimizing the regularization in size-consistent second-order Brillouin-Wigner perturbation theory
Kevin Carter-Fenk, James Shee, Martin Head-Gordon
The Journal of Chemical Physics
|
July 22, 2019
Self-consistent charge embedding at very low cost, with application to symmetry-adapted perturbation theory
Kuan-Yu Liu, Kevin Carter-Fenk, John M Herbert
Accounts of Chemical Research
|
March 3, 2025
Correction to "Predicting and Understanding Noncovalent Interactions Using Novel Forms of Symmetry-Adapted Perturbation Theory"
Kevin Carter-Fenk, Ka Un Lao, John M Herbert
Journal of Chemical Theory and Computation
|
June 30, 2021
Natural Charge-Transfer Analysis: Eliminating Spurious Charge-Transfer States in Time-Dependent Density Functional Theory via Diabatization, with Application to Projection-Based Embedding
Kevin Carter-Fenk, Christopher J Mundy, John M Herbert
Accounts of Chemical Research
|
September 22, 2021
Predicting and Understanding Non-Covalent Interactions Using Novel Forms of Symmetry-Adapted Perturbation Theory
Kevin Carter-Fenk, Ka Un Lao, John M Herbert
Journal of Chemical Theory and Computation
|
April 22, 2026
The Dose Makes the Poison: Perturbative Steps toward the Ultimate Linearized Coupled Cluster Method
Sylvia J Bintrim, Ella R Ransford, Kevin Carter-Fenk
The Journal of Chemical Physics
|
June 1, 2022
Computing x-ray absorption spectra from linear-response particles atop optimized holes
Diptarka Hait, Katherine J Oosterbaan, Kevin Carter-Fenk, et al.
The Journal of Physical Chemistry Letters
|
May 8, 2019
Accurate and Efficient ab Initio Calculations for Supramolecular Complexes: Symmetry-Adapted Perturbation Theory with Many-Body Dispersion
Kevin Carter-Fenk, Ka Un Lao, Kuan-Yu Liu, et al.
The Journal of Physical Chemistry Letters
|
October 10, 2022
Electron-Affinity Time-Dependent Density Functional Theory: Formalism and Applications to Core-Excited States
Kevin Carter-Fenk, Leonardo A Cunha, Juan E Arias-Martinez, et al.
The Journal of Physical Chemistry Letters
|
April 27, 2023
Correction to "Birth of the Hydrated Electron via Charge-Transfer-to-Solvent Excitation of Aqueous Iodide"
Kevin Carter-Fenk, Britta A Johnson, John M Herbert, et al.
Page
of 3