0000000001302628

AUTHOR

Antonietta Guagliardi

showing 17 related works from this author

Proton sponge lead halides containing 1D polyoctahedral chains

2021

Hybrid one-dimensional lead halides, containing the protonated 1,8-bis(dimethylamino)naphthalene moiety (C14H19N2, monoprotonated "proton sponge"), were prepared by simple one-pot methods and investigated in terms of crystal structure, morphology, thermal stability and electronic properties. The as-precipitated (C14H19N2)PbBr3 and (C14H19N2)PbI3 species are isostructural and crystallize in the orthorhombic Pbca space group, resulting in 1D crystal phases with ([PbX3](-))(infinity) chains (built by face-sharing [PbX6] octahedra; X = Br, I), among which the (C14H19N2)(+) cations are inserted. The two compounds display complete miscibility in the solid state: both (C14H19N2)PbI2Br and (C14H19N…

Materials science1D-pseudo perovskiteBand gapGeneral ChemistryCrystal structureCondensed Matter PhysicsCrystalhybrid lead halides trimethylsulfoxonium powder diffraction solid solution ionic defectivity periodic DFT calculationsCrystallographyOctahedronPhase (matter)General Materials ScienceOrthorhombic crystal systemThermal stabilityIsostructuralCrystEngComm
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Heterovalent BiIII/PbII ionic substitution in one-dimensional trimethylsulfoxonium halide pseudo-perovskites (X = I, Br)

2021

We report on the synthesis and characterization of novel lead and bismuth hybrid (organic-inorganic) iodide and bromide pseudo-perovskites (ABX3) containing the trimethylsulfoxonium cation (CH3)3SO+ (TMSO) in the A site, Pb/Bi in the B site, and Br or I as X anions. All of these compounds are isomorphic and crystallize in the orthorhombic Pnma space group. Lead-based pseudo-perovskites consist of one-dimensional (1D) chains of face-sharing [PbX6] octahedra, while in the bismuth-based ones, the chains of [BiX6] are interrupted, with one vacancy every third site, leading to a zero-dimensional (0D) local structure based on separated [Bi2I9]3- dimers. Five solid solutions for the iodide with di…

Electronic structureMaterials scienceBand gapHalideIonic bondingchemistry.chemical_elementElectronic structurePositive ionPerovskiteIonBismuthPhysical and Theoretical ChemistryPerovskite (structure)Design for testabilityX ray powder diffractionSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsEnergy gapCrystallographyGeneral EnergychemistryDensity functional theoryorganic-inorganic materialDensity functional theoryDefectBismuth
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Structural and magnetic characterization of Pd nanoparticles encapsulated in apoferritin

2010

Pd nanoparticles exhibiting permanent magnetism at room temperature have been prepared within the apoferritin cavity. Pd nanoparticles in air and under an inert atmosphere were synthesized to study the influence of the aerobic and anaerobic conditions in the final magnetic properties. The surface of nanoparticles as well as the type of crystalline phase could determine the magnetic properties. X-ray powder diffraction, including Debye-function analysis, transmission electronic microscopy, and magnetization measurements have been used for characterizing the nanoparticles.

Materials scienceMagnetismPhysics::OpticsNanoparticleBioengineeringMagneticsMagnetizationX-Ray DiffractionPhase (matter)General Materials ScienceElectrical and Electronic EngineeringInert gasMechanical EngineeringTemperatureGeneral Chemistryequipment and suppliesCharacterization (materials science)CrystallographyModels ChemicalChemical engineeringMechanics of MaterialsPd nanoparticlesApoferritinsNanoparticleshuman activitiesPalladiumPowder diffraction
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Modeling bismuth insertion in 1D hybrid lead halide TMSO(Pb x Bi y )I3 pseudo-perovskites

2022

Abstract The structures of the disordered 1D (pseudo-)perovskites of general TMSO(Pb x Bi y )I3 formulation [TMSO = (CH3)3SO+], obtained by doping the TMSOPbI3 species with Bi3+ ions, are investigated through the formulation of a statistical model of correlated disorder, which addresses the sequences of differently occupied BI6 face-sharing octahedra (B = Pb, Bi or vacant site) within ideally infinite [(BI3)−] n chains. The x-ray diffraction patterns simulated on the basis of the model are matched to the experimental traces, which show many broad peaks with awkward (nearly trapezoidal) shapes, under the assumption that the charge balance is fully accomplished within each chain. The analysis…

lead halideMechanical EngineeringBioengineeringGeneral Chemistryaliovalent dopingface-sharing octahedraXRD whole pattern simulation; aliovalent doping; face-sharing octahedra; hybrid perovskites; lead halide; structural disorderSettore CHIM/03 - Chimica Generale E Inorganicastructural disorderMechanics of MaterialsXRD whole pattern simulationGeneral Materials ScienceElectrical and Electronic Engineeringhybrid perovskitesNanotechnology
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Ultralow thermal conductivity in 1D and 2D imidazolium-based lead halide perovskites

2021

Low-dimensional hybrid organic–inorganic metal halide perovskites are rapidly emerging as a fascinating sub-class of the three-dimensional parent structures, thanks to their appealing charge and thermal transport properties, paired to better chemical and thermal stabilities. Extensive investigations of the thermal behavior in these systems are of paramount relevance to understand their optoelectronic and thermoelectric applications. Herein, we present a complete thermophysical characterization of imidazolium lead iodide, (IMI)PbI3, a 1D pseudo-perovskite with chains of face-sharing octahedra, and histammonium lead iodide, (HIST)PbI4, a 2D layered perovskite with corner-sharing octahedra. Up…

Metal halideLead compoundMaterials sciencePhysics and Astronomy (miscellaneous)HalidePelletizingIodine compoundThermal diffusivityPerovskiteThermodynamic stabilityThermal expansionPowder metalHybrid systemThermal conductivityChemical physicsLayered semiconductorThermoelectric effectThermalorganic-inorganic materialThermal stabilityThermal expansionPerovskite (structure)
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Conformationally rigid molecular and polymeric naphthalene-diimides containing C6H6N2 constitutional isomers

2021

Organic thin films based on naphthalenediimides (NDIs) bearing alkyl substituents have shown interesting properties for application in OLEDs, thermoelectrics, solar cells, sensors and organic electronics. However, the polymorphic versatility attributed to the flexibility of alkyl chains remains a challenging issue, with detrimental implications on the performances. Aryl analogues containing C6H6N2 constitutional isomers are herein investigated as one of the possible way-out strategies. The synthesis of molecular and polymeric species is described, starting from naphthaleneteracarboxyldianhydride with isomeric aromatic amines and hydrazine. The materials are fully characterized by spectrosco…

Materials scienceX ray diffractionStacking02 engineering and technology010402 general chemistry01 natural sciencesNDIUltraviolet visible spectroscopyMaterials ChemistryStructural isomerMoleculeThermal stabilityThin filmPolymerCrystallinityAlkylAmineThin film solar cellchemistry.chemical_classificationOrganic electronicsUltraviolet visible spectroscopySpin coatingGeneral Chemistry021001 nanoscience & nanotechnology0104 chemical sciencesEnergy gapIsomerNondestructive examinationCrystallographychemistry0210 nano-technologyStabilityNaphthalene
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CCDC 2059772: Experimental Crystal Structure Determination

2022

Related Article: Vincenzo Mirco Abbinante, Gonzalo García-Espejo, Gabriele Calabrese, Silvia Milita, Luisa Barba, Diego Marini, Candida Pipitone, Francesco Giannici, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Mater.Chem.C|9|10875|doi:10.1039/d1tc00564b

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters27-bis(3-aminophenyl)benzo[lmn][38]phenanthroline-1368(2H7H)-tetroneExperimental 3D Coordinates
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CCDC 2069442: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Gonzalo Garc��a-Espejo, Silvia Carlotto, Maurizio Casarin, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Phys.Chem.C|125|11728|doi:10.1021/acs.jpcc.1c02571

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameterscatena-[tris(trimethylsulfoxonium) bis(tris(mu-bromo)-bismuth) tris(bromide)]Experimental 3D Coordinates
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CCDC 2012750: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Federica Bertolotti, Gabriele Calabrese, Silvia Milita, Antonietta Guagliardi, Norberto Masciocchi|2021|CrystEngComm|23|1126|doi:10.1039/D0CE01695K

Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinatescatena-[(8-(dimethylamino)-NN-dimethylnaphthalen-1-aminium) tris(mu-iodo)-lead(ii)]
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CCDC 2059771: Experimental Crystal Structure Determination

2022

Related Article: Vincenzo Mirco Abbinante, Gonzalo García-Espejo, Gabriele Calabrese, Silvia Milita, Luisa Barba, Diego Marini, Candida Pipitone, Francesco Giannici, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Mater.Chem.C|9|10875|doi:10.1039/d1tc00564b

Space GroupCrystallography27-bis(4-aminophenyl)benzo[lmn][38]phenanthroline-1368(2H7H)-tetroneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2069441: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Gonzalo Garc��a-Espejo, Silvia Carlotto, Maurizio Casarin, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Phys.Chem.C|125|11728|doi:10.1021/acs.jpcc.1c02571

Space GroupCrystallographycatena-[trimethylsulfoxonium tris(mu-iodo)-lead]Crystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2069440: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Gonzalo Garc��a-Espejo, Silvia Carlotto, Maurizio Casarin, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Phys.Chem.C|125|11728|doi:10.1021/acs.jpcc.1c02571

catena-[trimethylsulfoxonium tris(mu-bromo)-lead]Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2069439: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Gonzalo Garc��a-Espejo, Silvia Carlotto, Maurizio Casarin, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Phys.Chem.C|125|11728|doi:10.1021/acs.jpcc.1c02571

Space GroupCrystallographyCrystal SystemCrystal Structurecatena-[tris(trimethylsulfoxonium) bis(tris(mu-iodo)-bismuth) tris(iodide)]Cell ParametersExperimental 3D Coordinates
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CCDC 2059770: Experimental Crystal Structure Determination

2022

Related Article: Vincenzo Mirco Abbinante, Gonzalo García-Espejo, Gabriele Calabrese, Silvia Milita, Luisa Barba, Diego Marini, Candida Pipitone, Francesco Giannici, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Mater.Chem.C|9|10875|doi:10.1039/d1tc00564b

Space GroupCrystallographyCrystal System27-dianilinobenzo[lmn][38]phenanthroline-1368(2H7H)-tetroneCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2012751: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Federica Bertolotti, Gabriele Calabrese, Silvia Milita, Antonietta Guagliardi, Norberto Masciocchi|2021|CrystEngComm|23|1126|doi:10.1039/D0CE01695K

Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinatescatena-[(8-(dimethylamino)-NN-dimethylnaphthalen-1-aminium) tris(mu-iodo)-lead(ii)]
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CCDC 2012752: Experimental Crystal Structure Determination

2021

Related Article: Candida Pipitone, Francesco Giannici, Antonino Martorana, Federica Bertolotti, Gabriele Calabrese, Silvia Milita, Antonietta Guagliardi, Norberto Masciocchi|2021|CrystEngComm|23|1126|doi:10.1039/D0CE01695K

Space GroupCrystallographycatena-[(8-(dimethylamino)-NN-dimethylnaphthalen-1-aminium) tris(mu-bromo)-lead(ii)]Crystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2059769: Experimental Crystal Structure Determination

2022

Related Article: Vincenzo Mirco Abbinante, Gonzalo García-Espejo, Gabriele Calabrese, Silvia Milita, Luisa Barba, Diego Marini, Candida Pipitone, Francesco Giannici, Antonietta Guagliardi, Norberto Masciocchi|2021|J.Mater.Chem.C|9|10875|doi:10.1039/d1tc00564b

Space GroupCrystallographypoly-(1458-naphthalenetetracarboxyl-p-phenylenedimide)Crystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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