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Table representation of search results timeline featuring number of search results per year.
Year | Number of Results |
---|---|
2022 | 2 |
2023 | 3 |
2024 | 0 |
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Page 1
Bridging physical intuition and hardware efficiency for correlated electronic states: the local unitary cluster Jastrow ansatz for electronic structure.
Chem Sci. 2023 Sep 21;14(40):11213-11227. doi: 10.1039/d3sc02516k. eCollection 2023 Oct 18.
Chem Sci. 2023.
PMID: 37860666
Free PMC article.
Indolo[2,3-b]quinoxaline as a Low Reduction Potential and High Stability Anolyte Scaffold for Nonaqueous Redox Flow Batteries.
Zhang W, Walser-Kuntz R, Tracy JS, Schramm TK, Shee J, Head-Gordon M, Chen G, Helms BA, Sanford MS, Toste FD.
Zhang W, et al.
J Am Chem Soc. 2023 Aug 30;145(34):18877-18887. doi: 10.1021/jacs.3c05210. Epub 2023 Aug 16.
J Am Chem Soc. 2023.
PMID: 37585274
Free PMC article.
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Caught in the act: real-time observation of the solvent response that promotes excited-state proton transfer in pyranine.
Hoberg C, Talbot JJ, Shee J, Ockelmann T, Das Mahanta D, Novelli F, Head-Gordon M, Havenith M.
Hoberg C, et al.
Chem Sci. 2023 Mar 16;14(15):4048-4058. doi: 10.1039/d2sc07126f. eCollection 2023 Apr 12.
Chem Sci. 2023.
PMID: 37063810
Free PMC article.
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Concerted Electron-Nuclear Motion in Proton-Coupled Electron Transfer-Driven Grotthuss-Type Proton Translocation.
Arsenault EA, Guerra WD, Shee J, Reyes Cruz EA, Yoneda Y, Wadsworth BL, Odella E, Urrutia MN, Kodis G, Moore GF, Head-Gordon M, Moore AL, Moore TA, Fleming GR.
Arsenault EA, et al.
J Phys Chem Lett. 2022 May 26;13(20):4479-4485. doi: 10.1021/acs.jpclett.2c00585. Epub 2022 May 14.
J Phys Chem Lett. 2022.
PMID: 35575065
Free PMC article.
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Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Toward Benchmark Quantum Chemistry for Transition Metals.
Rudshteyn B, Weber JL, Coskun D, Devlaminck PA, Zhang S, Reichman DR, Shee J, Friesner RA.
Rudshteyn B, et al.
J Chem Theory Comput. 2022 May 10;18(5):2845-2862. doi: 10.1021/acs.jctc.1c01071. Epub 2022 Apr 4.
J Chem Theory Comput. 2022.
PMID: 35377642
Free PMC article.
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