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1Materias: “...calculation...”
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2Materias: “...Quantum calculation...”
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3Materias: “...calculation...”
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4Materias: “...calculation...”
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5Materias: “...calculation...”
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6Materias: “...DFT calculations...”
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7Materias: “...calculation...”
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8Materias: “...calculation...”
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9Materias: “...calculation...”
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10Materias: “...calculation...”
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11Structure and spin-state energetics of an iron porphyrin model: An assessment of theoretical methodsMaterias: “...Calculations...”
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12Materias: “...ab initio calculation...”
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