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chemical binding
chemical structure
Article
2
Binary alloys
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Coordination sphere
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Copper
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Copper alloys
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DFT
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Electron transfer
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Electronic perturbations
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Electronic structure
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Energy gap
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Engineered site
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Geometric changes
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Ground state
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Heme-copper oxidase
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Orders of magnitude
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Potential energy
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Quantum chemistry
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Solvent effects
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Synthetic systems
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Transition metal complexes
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aliphatic amine
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ammonia
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aqueous solution
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article
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calculation
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chemical interaction
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chemical modification
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chemical parameters
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1Publicado 2001Materias: “...quantum chemistry...”
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2Materias: “...quantum chemistry...”
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3Publicado 2019Materias: “...Quantum chemistry...”
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4por Leguto, A.J., Smith, M.A., Morgada, M.N., Zitare, U.A., Murgida, D.H., Lancaster, K.M., Vila, A.J.Materias: “...Quantum chemistry...”
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