Recent questions in Quantum Chemistry

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How do the electronic and optical properties of graphene and other 2D materials vary with changes in temperature and doping concentration?

asked Feb 20 in Quantum Chemistry by AlmedaGooch6 (1.7k points)

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How do changes in the number of carbon layers affect the electronic and optical properties of graphene and other 2D materials?

asked Feb 20 in Quantum Chemistry by SheilaSchaef (1.8k points)

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How do changes in the number of layers and presence of defects affect the electronic and optical properties of graphene and other 2D materials, with a focus on the band gap and excitonic effects?

asked Feb 20 in Quantum Chemistry by YRPAbe659621 (2.3k points)

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How do the electronic and optical properties of graphene and 2D materials vary with changes in their structural defects and doping level?

asked Feb 20 in Quantum Chemistry by MoniqueBrins (1.9k points)

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How do the electronic and optical properties of conjugated polymers vary as the size of the polymer chain increases?

asked Feb 20 in Quantum Chemistry by JamisonKwan8 (1.7k points)

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How do the electronic and optical properties of conjugated polymers change with varying pi-conjugation lengths?

asked Feb 20 in Quantum Chemistry by DorothyHendo (2.2k points)

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What is the correlation between the electronic and optical properties of conjugated polymers and their molecular structure, specifically the length of the conjugated backbone?

asked Feb 20 in Quantum Chemistry by NicholeBueno (1.8k points)

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What are the electronic and optical properties of a specific conjugated polymer and how can they be calculated using quantum chemistry models?

asked Feb 20 in Quantum Chemistry by MervinBowden (2.1k points)

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How does the electronic and magnetic structure of topological materials influence their physical and chemical properties, and how can this knowledge be leveraged to design novel functional materials for future technological applications?

asked Feb 20 in Quantum Chemistry by ShaunBehan45 (2.8k points)

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1 answer 28 views

How do the electronic and magnetic properties of transition metal complexes change when different ligands are coordinated, and how can we use quantum chemical calculations to predict these changes?

asked Feb 20 in Quantum Chemistry by JamisonKwan8 (1.7k points)

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How do the electronic and magnetic properties of transition metal complexes vary as a function of the metal's atomic number and the ligands attached to it?

asked Feb 20 in Quantum Chemistry by MacDeLoitte (1.8k points)

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How do the electronic and magnetic properties of transition metal complexes vary with changes in their ligand environments and oxidation states?

asked Feb 20 in Quantum Chemistry by TahliaEvatt8 (2.2k points)

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How do the electronic and magnetic properties of transition metal complexes vary with the change in ligands and the oxidation state of the metal center?

asked Feb 20 in Quantum Chemistry by RigobertoWat (1.5k points)

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How do the electronic and magnetic properties of topological materials vary with temperature and external magnetic field?

asked Feb 20 in Quantum Chemistry by XGDKali55905 (2.7k points)

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How do the electronic and magnetic properties of metal-organic frameworks affect their performance as catalysts for specific chemical reactions?

asked Feb 20 in Quantum Chemistry by JadaMeece33 (1.6k points)

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How might the electronic and magnetic properties of metal-organic frameworks be predicted through the use of quantum chemistry calculations?

asked Feb 20 in Quantum Chemistry by KristalDmb02 (1.6k points)

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How do different metal ions affect the electronic and magnetic properties of metal-organic frameworks, and what is the influence of the organic ligands on these properties?

asked Feb 20 in Quantum Chemistry by MariRosetta0 (2.2k points)

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What is the correlation between the electronic and magnetic properties of metal-organic frameworks and their topology? Can topological analysis be used to predict the electronic and magnetic properties of novel metal-organic frameworks?

asked Feb 20 in Quantum Chemistry by AlineBacon1 (1.5k points)

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What is the relationship between the electronic and magnetic properties of metal-organic frameworks and their crystal structures? How does this affect their potential uses in gas storage, catalysis and molecular sensing?

asked Feb 20 in Quantum Chemistry by Lynell160113 (1.8k points)

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1 answer 34 views

What are the electronic and magnetic properties of a particular molecular magnet, and how can we predict them using quantum chemistry calculations?

asked Feb 20 in Quantum Chemistry by GilbertoPick (1.7k points)

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