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DFT Calculations of Isotropic Hyperfine Coupling Constants of Nitrogen Aromatic Radicals: The Challenge of Nitroxide Radicals.Extension of the AMBER Force Field for Nitroxide Radicals and Combined QM/MM/PCM Approach to the Accurate Determination of EPR Parameters of DMPO-H in Solution.On the road to MM'X polymers: redox properties of heterometallic Ni···Pt paddlewheel complexes.Possibility of [1,5] sigmatropic shifts in bicyclo[4.2.0]octa-2,4-dienes.Modeling of cw-EPR spectra of propagating radicals in methacrylic polymerization at different temperatures.Raman Detection of “Ambiguous” Conjugated Biradicals: Rapid Thermal Singlet-to-Triplet Intersystem Crossing in an Extended ViologenO–O Bond activation in H2O2 and (CH3)3C-OOH mediated by [Ni(cyclam)(CH3CN)2](ClO4)2: Different mechanisms to form the same Ni(iii) product?Density functional theory study of 14N isotropic hyperfine coupling constants of organic radicalsDensity functional theory predictions of isotropic hyperfine coupling constantsTheoretical isotropic hyperfine coupling constants of third-row nuclei (29Si, 31P, and 33S)
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Q40276279-3094CBEC-5877-4779-BBE3-FF4AE71C95A8Q40302757-CFA57FF8-F2C6-46E0-91DD-A28627F96271Q46836499-2ACD26BF-5C9B-4E9D-9224-8D8472EEB500Q49161378-48AC33AB-BF95-4EB6-AF85-C6F44A650616Q51871149-3B8434A6-B92F-488C-A989-DD0D8D45697EQ56457039-A273A928-9673-4652-A3F2-1C247AEB8CD8Q63444975-DFADEAFD-5B49-40CE-BB6C-7EB1F5EC021DQ79430257-303C76FF-87C4-4115-A141-234A7242CE47Q79879171-0C686820-7173-4E36-BC53-CE18FC11DAABQ79881663-AC7D7F74-1E4B-47D1-AA70-5151741C762F
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description
investigador
@es
researcher
@en
wetenschapper
@nl
name
L Hermosilla
@en
L Hermosilla
@nl
type
label
L Hermosilla
@en
L Hermosilla
@nl
prefLabel
L Hermosilla
@en
L Hermosilla
@nl
P31
P496
0000-0002-9905-2606