James Shee

Physics and AstronomyMaterials ScienceChemistryEnergy

Pilot corpus only

This score is computed over theSindex pilot corpus and does not cover the full scientific literature. Scores are relative to papers we have ingested — papers, authors, and institutions outside the pilot are not represented. Methodology.

Top 100%percentile

0Author DataRank

Indexed papers

0in pilot corpus

datarank_citation_only_1hop_v6· scope data_onlyMethodology

Papers

Driven by 22 papers. Top paper: “Solvent Assisted Excited State Proton Transfer in Indigo Carmine Investigated by Two-Dimensional Electronic-Vibrational Spectroscopy”.

Solvent Assisted Excited State Proton Transfer in Indigo Carmine Investigated by Two-Dimensional Electronic-Vibrational Spectroscopy

The 22nd International Conference on Ultrafast Phenomena 2020(2020)10.1364/up.2020.m4b.8

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0DataRank · unranked

0 citations

James Shee, Eric A. Arsenault, Yusuke Yoneda, Katelyn Feuling, Martin Head‐Gordon +2 more

Regularized Second-Order Møller–Plesset Theory: A More Accurate Alternative to Conventional MP2 for Noncovalent Interactions and Transition Metal Thermochemistry for the Same Computational Cost

The Journal of Physical Chemistry Letters(2021)10.1021/acs.jpclett.1c03468

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83 citations

Matthias Loipersberger, Adam Rettig, Joonho Lee, Martin Head‐Gordon, James Shee

Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Towards Benchmark Quantum Chemistry for Transition Metals

ChemRxiv(2021)10.26434/chemrxiv.14751684.v1

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0DataRank · unranked

1 citations

John Weber, Dilek Coskun, Pierre A. Devlaminck, Shiwei Zhang, David R. Reichman +3 more

Regularized Second Order Møller-Plesset Theory: A More Accurate Alternative to Conventional MP2 for Noncovalent Interactions and Transition Metal Thermochemistry for the Same Compute Cost

(2021)10.33774/chemrxiv-2021-4gqbq

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0DataRank · unranked

0 citations

Matthias Loipersberger, Adam Rettig, Joonho Lee, Martin Head‐Gordon, James Shee

Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Towards Benchmark Quantum Chemistry for Transition Metals

ChemRxiv(2021)10.26434/chemrxiv-2021-l4t2f-v2

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0DataRank · unranked

0 citations

John L. Weber, Dilek Coskun, Pierre A. Devlaminck, Shiwei Zhang, David R. Reichman +3 more

Regularized Second Order Møller-Plesset Theory: A More Accurate Alternative to Conventional MP2 for Noncovalent Interactions and Transition Metal Thermochemistry for the Same Compute Cost

ChemRxiv(2021)10.26434/chemrxiv-2021-4gqbq

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0DataRank · unranked

0 citations

Matthias Loipersberger, Adam Rettig, Joonho Lee, Martin Head‐Gordon, James Shee

Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Towards Benchmark Quantum Chemistry for Transition Metals

ChemRxiv(2021)10.26434/chemrxiv.14751684

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0DataRank · unranked

0 citations

John Weber, Dilek Coskun, Pierre A. Devlaminck, Shiwei Zhang, David R. Reichman +3 more

Caught in the act: real-time observation of the solvent response that promotes excited-state proton transfer in pyranine

ChemRxiv(2022)10.26434/chemrxiv-2021-60zjv-v3

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1 citations

Justin J. Talbot, James Shee, Thorsten Ockelmann, Debasish Das Mahanta, Fabio Novelli +3 more

Caught in the act: Observation of the solvent response triggered by excited-state proton transfer in real time

ChemRxiv(2022)10.26434/chemrxiv-2021-60zjv-v2

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0DataRank · unranked

0 citations

Thorsten Ockelmann, James Shee, Patrick Balzerowski, Debasish Das Mahanta, Fabio Novelli +3 more

Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Towards Benchmark Quantum Chemistry for Transition Metals

(2022)10.33774/chemrxiv-2021-l4t2f-v3

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0DataRank · unranked

0 citations

John L. Weber, Dilek Coskun, Pierre A. Devlaminck, Shiwei Zhang, David R. Reichman +3 more

Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Towards Benchmark Quantum Chemistry for Transition Metals

ChemRxiv(2022)10.26434/chemrxiv-2021-l4t2f-v3

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0DataRank · unranked

0 citations

John L. Weber, Dilek Coskun, Pierre A. Devlaminck, Shiwei Zhang, David R. Reichman +3 more

Revisiting the Orbital Energy Dependent Regularization of Orbital Optimized Second Order Møller-Plesset Theory

ChemRxiv(2022)10.26434/chemrxiv-2022-rzmdx

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0 citations

James Shee, Joonho Lee, Martin Head‐Gordon, Adam Rettig

On the potentially transformative role of auxiliary-field quantum Monte Carlo in quantum chemistry: A highly accurate method for transition metals and beyond

ChemRxiv(2022)10.26434/chemrxiv-2022-cw19h

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0DataRank · unranked

0 citations

John L. Weber, David R. Reichman, Richard A. Friesner, Shiwei Zhang, James Shee

Bridging physical intuition and hardware efficiency for correlated electronic states: the local unitary cluster Jastrow ansatz for electronic structure

Chemical Science(2023)10.1039/d3sc02516k

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45 citations

Kevin J. Sung, K. Birgitta Whaley, Martin Head‐Gordon, James Shee, Mário Motta

Say NO to Optimization: A Nonorthogonal Quantum Eigensolver

PRX Quantum(2023)10.1103/prxquantum.4.030307

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0DataRank · unranked

44 citations

Diptarka Hait, James Shee, Oskar Leimkuhler, William J. Huggins, Torin F. Stetina +3 more

Indolo[2,3-b]quinoxaline as a Low Reduction Potential and High Stability Anolyte Scaffold for Nonaqueous Redox Flow Batteries

Journal of the American Chemical Society(2023)10.1021/jacs.3c05210

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26 citations

Ryan Walser-Kuntz, Jacob S. Tracy, Tim K. Schramm, James Shee, Martin Head‐Gordon +5 more

Caught in the act: real-time observation of the solvent response that promotes excited-state proton transfer in pyranine

Chemical Science(2023)10.1039/d2sc07126f

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0DataRank · unranked

24 citations

Justin J. Talbot, James Shee, Thorsten Ockelmann, Debasish Das Mahanta, Fabio Novelli +3 more

On the potentially transformative role of auxiliary-field quantum Monte Carlo in quantum chemistry: A highly accurate method for transition metals and beyond

The Journal of Chemical Physics(2023)10.1063/5.0134009

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0DataRank · unranked

26 citations

John L. Weber, David R. Reichman, Richard A. Friesner, Shiwei Zhang, James Shee

Optimizing the regularization in size-consistent second-order Brillouin-Wigner perturbation theory

The Journal of Chemical Physics(2023)10.1063/5.0174923

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0DataRank · unranked

18 citations

James Shee, Martin Head‐Gordon, Kevin Carter-Fenk

Bridging physical intuition and hardware efficiency for correlated electronic states: the local unitary cluster Jastrow ansatz for electronic structure

ChemRxiv(2023)10.26434/chemrxiv-2023-d1b3l

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0DataRank · unranked

2 citations

Kevin J. Sung, K. Birgitta Whaley, Martin Head‐Gordon, James Shee, Mário Motta

Optimizing the Regularization in Size-Consistent Second-Order Brillouin-Wigner Perturbation Theory

arXiv (Cornell University)(2023)10.48550/arxiv.2309.01376

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0DataRank · unranked

0 citations

James Shee, Martin Head‐Gordon, Kevin Carter-Fenk

Regioisomeric Engineering for Multicharge and Spin Stabilization in Two-Electron Organic Catholytes

Journal of the American Chemical Society(2025)10.1021/jacs.4c16027

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0DataRank · unranked

3 citations

Tim K. Schramm, Martin Head‐Gordon, James Shee, F. Dean Toste, Hyung-Keun Chung