Finite-temperature DFT shows electronic entropy drives one or two solid-solid phase transitions in all studied metals except Mg and Pb.
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cond-mat.mtrl-sci 2years
2026 2verdicts
UNVERDICTED 2representative citing papers
Electronic temperature reduces structural diversity in transition metals by favoring fcc structures, with bcc stabilized mainly by compression and hcp as a secondary phase.
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Electronic-Entropy-Driven Solid-Solid Phase Transitions in Elemental Metals
Finite-temperature DFT shows electronic entropy drives one or two solid-solid phase transitions in all studied metals except Mg and Pb.
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From Entropy to Compression: Competing Thermodynamic Drivers of Structural Transitions in Transition Metals
Electronic temperature reduces structural diversity in transition metals by favoring fcc structures, with bcc stabilized mainly by compression and hcp as a secondary phase.