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(color online) dft energy-phase diagrams for atomic wires. pointsDft examples (color online) phase diagram as calculated within the dft and dft+dmft(color online) phase diagram obtained in dft+dmft for u = 4 ev.
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The flow chart of a dft calculation. the dft formula (e.g., lda) is(a) the computational flowchart of dft calculations combined with Dft dmftPhase diagrams at 0 k constructed with dft calculations from the mp.
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