DeBeer S - Search Results

1

Structural correlations of nitrogenase active sites using nuclear resonance vibrational spectroscopy and QM/MM calculations.

Van Stappen C, Benediktsson B, Rana A, Chumakov A, Yoda Y, Bessas D, Decamps L, Bjornsson R, DeBeer S. Van Stappen C, et al. Among authors: debeer s. Faraday Discuss. 2023 Jul 19;243(0):253-269. doi: 10.1039/d2fd00174h. Faraday Discuss. 2023. PMID: 37067436

2

High-resolution molybdenum K-edge X-ray absorption spectroscopy analyzed with time-dependent density functional theory.

Lima FA, Bjornsson R, Weyhermüller T, Chandrasekaran P, Glatzel P, Neese F, DeBeer S. Lima FA, et al. Among authors: debeer s. Phys Chem Chem Phys. 2013 Dec 28;15(48):20911-20. doi: 10.1039/c3cp53133c. Phys Chem Chem Phys. 2013. PMID: 24197060

3

The discovery of Mo(III) in FeMoco: reuniting enzyme and model chemistry.

Bjornsson R, Neese F, Schrock RR, Einsle O, DeBeer S. Bjornsson R, et al. Among authors: debeer s. J Biol Inorg Chem. 2015 Mar;20(2):447-60. doi: 10.1007/s00775-014-1230-6. Epub 2014 Dec 31. J Biol Inorg Chem. 2015. PMID: 25549604 Free PMC article. Review.

4

Molybdenum L-Edge XAS Spectra of MoFe Nitrogenase.

Bjornsson R, Delgado-Jaime MU, Lima FA, Sippel D, Schlesier J, Weyhermüller T, Einsle O, Neese F, DeBeer S. Bjornsson R, et al. Among authors: debeer s. Z Anorg Allg Chem. 2015 Jan;641(1):65-71. doi: 10.1002/zaac.201400446. Epub 2014 Nov 27. Z Anorg Allg Chem. 2015. PMID: 26213424 Free PMC article.

5

The Fe-V Cofactor of Vanadium Nitrogenase Contains an Interstitial Carbon Atom.

Rees JA, Bjornsson R, Schlesier J, Sippel D, Einsle O, DeBeer S. Rees JA, et al. Among authors: debeer s. Angew Chem Int Ed Engl. 2015 Nov 2;54(45):13249-52. doi: 10.1002/anie.201505930. Epub 2015 Sep 17. Angew Chem Int Ed Engl. 2015. PMID: 26376620 Free PMC article.

6

X-ray Absorption and Emission Spectroscopic Studies of [L2Fe2S2](n) Model Complexes: Implications for the Experimental Evaluation of Redox States in Iron-Sulfur Clusters.

Kowalska JK, Hahn AW, Albers A, Schiewer CE, Bjornsson R, Lima FA, Meyer F, DeBeer S. Kowalska JK, et al. Among authors: debeer s. Inorg Chem. 2016 May 2;55(9):4485-97. doi: 10.1021/acs.inorgchem.6b00295. Epub 2016 Apr 20. Inorg Chem. 2016. PMID: 27097289 Free PMC article.

7

Revisiting the Mössbauer Isomer Shifts of the FeMoco Cluster of Nitrogenase and the Cofactor Charge.

Bjornsson R, Neese F, DeBeer S. Bjornsson R, et al. Among authors: debeer s. Inorg Chem. 2017 Feb 6;56(3):1470-1477. doi: 10.1021/acs.inorgchem.6b02540. Epub 2017 Jan 10. Inorg Chem. 2017. PMID: 28071903 Free article.

8

Comparative electronic structures of nitrogenase FeMoco and FeVco.

Rees JA, Bjornsson R, Kowalska JK, Lima FA, Schlesier J, Sippel D, Weyhermüller T, Einsle O, Kovacs JA, DeBeer S. Rees JA, et al. Among authors: debeer s. Dalton Trans. 2017 Feb 21;46(8):2445-2455. doi: 10.1039/c7dt00128b. Dalton Trans. 2017. PMID: 28154874 Free PMC article.

9

Investigations of the Magnetic and Spectroscopic Properties of V(III) and V(IV) Complexes.

Van Stappen C, Maganas D, DeBeer S, Bill E, Neese F. Van Stappen C, et al. Among authors: debeer s. Inorg Chem. 2018 Jun 4;57(11):6421-6438. doi: 10.1021/acs.inorgchem.8b00486. Epub 2018 May 23. Inorg Chem. 2018. PMID: 29791147

10

X-ray Magnetic Circular Dichroism Spectroscopy Applied to Nitrogenase and Related Models: Experimental Evidence for a Spin-Coupled Molybdenum(III) Center.

Kowalska JK, Henthorn JT, Van Stappen C, Trncik C, Einsle O, Keavney D, DeBeer S. Kowalska JK, et al. Among authors: debeer s. Angew Chem Int Ed Engl. 2019 Jul 8;58(28):9373-9377. doi: 10.1002/anie.201901899. Epub 2019 Jun 18. Angew Chem Int Ed Engl. 2019. PMID: 31119827 Free PMC article.

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