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Akademický článek

Charge-Transfer Spectroscopy of Bisaxially Coordinated Iron(II) Phthalocyanines through the Prism of the Lever's E L Parameters Scale, MCD Spectroscopy, and TDDFT Calculations.

Autor: Nevonen DE; Department of Chemistry, University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada., Ferch LS; Department of Chemistry, University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada., Schrage BR; Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996, United States., Nemykin VN; Department of Chemistry, University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada.; Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996, United States.

Publikováno v: Inorganic chemistry [Inorg Chem] 2022 May 30; Vol. 61 (21), pp. 8250-8266. Date of Electronic Publication: 2022 May 13.

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Akademický článek

Application of Lever's E L Parameter Scale toward Fe(II)/Fe(III) versus Pc(2-)/Pc(1-) Oxidation Process Crossover Point in Axially Coordinated Iron(II) Phthalocyanine Complexes.

Autor: Nemykin VN; Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996, United States.; Department of Chemistry, University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada., Nevonen DE; Department of Chemistry, University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada., Osterloh WR; Department of Chemistry, University of Houston, Houston, Texas 77204-5003, United States., Ferch LS; Department of Chemistry, University of Manitoba, Winnipeg, Manitoba R3T 2N2, Canada., Harrison LA; Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996, United States., Marx BS; Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996, United States., Kadish KM; Department of Chemistry, University of Houston, Houston, Texas 77204-5003, United States.

Publikováno v: Inorganic chemistry [Inorg Chem] 2021 Nov 01; Vol. 60 (21), pp. 16626-16644. Date of Electronic Publication: 2021 Oct 13.

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Akademický článek

Accurate Prediction of Mössbauer Hyperfine Parameters in Bis-Axially Coordinated Iron(II) Phthalocyanines Using Density Functional Theory Calculations: A Story of a Single Orbital Revealed by Natural Bond Orbital Analysis.

Autor: Nemykin VN; Department of Chemistry, University of Manitoba, Winnipeg, MB R3T 2N2, Canada.; Department of Chemistry, University of Tennessee, Knoxville, Tennessee 37996, United States., Nevonen DE; Department of Chemistry, University of Manitoba, Winnipeg, MB R3T 2N2, Canada., Ferch LS; Department of Chemistry, University of Manitoba, Winnipeg, MB R3T 2N2, Canada., Shepit M; Department of Physics and Astronomy, University of Manitoba, Winnipeg, MB R3T 2N2, Canada., Herbert DE; Department of Chemistry, University of Manitoba, Winnipeg, MB R3T 2N2, Canada., van Lierop J; Department of Physics and Astronomy, University of Manitoba, Winnipeg, MB R3T 2N2, Canada.

Publikováno v: Inorganic chemistry [Inorg Chem] 2021 Mar 15; Vol. 60 (6), pp. 3690-3706. Date of Electronic Publication: 2021 Mar 02.

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Akademický článek

Adsorption of Actinide (U-Pu) Complexes on the Silicene and Germanene Surface: A Theoretical Study.

Autor: Grover P; Department of Chemistry , University of Manitoba , Winnipeg , MB R3T 2N2 , Canada., Ferch LS; Department of Chemistry , University of Manitoba , Winnipeg , MB R3T 2N2 , Canada., Schreckenbach G; Department of Chemistry , University of Manitoba , Winnipeg , MB R3T 2N2 , Canada.

Publikováno v: The journal of physical chemistry. A [J Phys Chem A] 2020 Feb 27; Vol. 124 (8), pp. 1522-1534. Date of Electronic Publication: 2020 Feb 17.

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