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Photophysical Integrity of the Iron(III) Scorpionate Framework in Iron(III)-NHC Complexes with Long-Lived 2LMCT Excited States.
Inorg Chem. 2022 Nov 7;61(44):17515-17526. doi: 10.1021/acs.inorgchem.2c02410. Epub 2022 Oct 24.
Inorg Chem. 2022.
PMID: 36279568
Free PMC article.
Ligand-centered to metal-centered activation of a Rh(iii) photosensitizer revealed by ab initio molecular dynamics simulations.
Losada IB, Persson P.
Losada IB, et al.
Chem Sci. 2023 Nov 2;14(47):13713-13721. doi: 10.1039/d3sc04381a. eCollection 2023 Dec 6.
Chem Sci. 2023.
PMID: 38075662
Free PMC article.
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Photoredox matching of earth-abundant photosensitizers with hydrogen evolving catalysts by first-principles predictions.
Losada IB, Persson P.
Losada IB, et al.
J Chem Phys. 2024 Feb 21;160(7):074302. doi: 10.1063/5.0174837.
J Chem Phys. 2024.
PMID: 38375904
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How Rigidity and Conjugation of Bidentate Ligands Affect the Geometry and Photophysics of Iron N-Heterocyclic Complexes: A Comparative Study.
Prakash O, Chábera P, Kaul N, Hlynsson VF, Rosemann NW, Losada IB, Hoang Hai YT, Huang P, Bendix J, Ericsson T, Häggström L, Gupta AK, Strand D, Yartsev A, Lomoth R, Persson P, Wärnmark K.
Prakash O, et al. Among authors: losada ib.
Inorg Chem. 2024 Mar 11;63(10):4461-4473. doi: 10.1021/acs.inorgchem.3c03972. Epub 2024 Feb 29.
Inorg Chem. 2024.
PMID: 38421802
Free PMC article.
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