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How can we predict the reactivity of inorganic compounds based on their electronic configuration and what factors influence this reactivity?

asked Feb 14 in Inorganic Chemistry by KatriceS6445 (1.7k points)

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asked Feb 14 in Quantum Chemistry by LeannaCremea (1.6k points)

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asked Feb 14 in Computational Chemistry by LeaDoss42672 (1.8k points)

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asked Feb 14 in Quantum Chemistry by AdelaideYwt4 (1.6k points)

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How can we predict the magnetic properties of a molecular magnet using quantum chemistry calculations?

asked Feb 14 in Quantum Chemistry by ChastityHoll (1.8k points)

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What is the predicted rate and mechanism of the reaction between hydrogen gas and oxygen gas at a temperature of 298 K and a pressure of 1 atm using quantum chemistry calculations?

asked Feb 14 in Quantum Chemistry by VenusU65079 (1.8k points)

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What is the predicted color of a compound containing a transition metal ion with an oxidation state of +3 in an octahedral geometry?

asked Feb 14 in Inorganic Chemistry by BradfordConr (2.2k points)

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asked Feb 14 in Chemical bonding by MarlaColes2 (2.1k points)

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How can we predict the electronic and magnetic properties of transition metal complexes using quantum chemistry calculations, and how do these properties affect the reactivity of the complex in various chemical reactions?

asked Feb 14 in Quantum Chemistry by Marilynn3793 (2.1k points)

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How can we predict the electronic and magnetic properties of topological materials using quantum mechanical calculations?

asked Feb 14 in Quantum Chemistry by WilheminaBel (2.0k points)

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How can we predict the electronic and magnetic properties of molecular magnets using quantum chemistry methods?

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How can we predict the electronic and magnetic properties of metal-organic frameworks using quantum chemistry calculations?

asked Feb 14 in Quantum Chemistry by MilfordFlore (2.0k points)

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How can we predict the electronic and magnetic properties of metal-organic frameworks based on their molecular structure and composition?

asked Feb 14 in Quantum Chemistry by NilaBody107 (1.7k points)

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How can we predict the electronic and magnetic properties of specific metal-organic frameworks and their potential applications in catalysis, energy storage, and gas separation?

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How can we predict the crystal structures of inorganic solids using different computational methods and experimental techniques?

asked Feb 14 in Inorganic Chemistry by JeremyCanady (2.1k points)

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How to predict the crystal structure of inorganic solids having high symmetry and complex bonding environments?

asked Feb 14 in Inorganic Chemistry by EmmettVerdin (2.2k points)

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