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February 14, 2026Physical Chemistry Chemical Physics0 citations

Accurate relativistic density functional calculations for the solid-state of metallic francium

ARAndres Robles-NavarroPSPeter Schwerdtfeger

Key Points

  • The research aims to explore the bulk properties of francium using advanced density functional theory techniques with relativistic corrections.
  • Utilized density functional theory
  • Applied the projector augmented wave method
  • Incorporated relativistic corrections
  • Considered zero-point vibrational effects
  • Identified significant bulk properties of francium
  • Showcased the effects of relativistic corrections on calculations
  • Highlighted the importance of zero-point vibrational effects in metallic behavior

Abstract

Bulk properties of the heaviest known Group 1 element francium are investigated by using density functional theory within the projector augmented wave method including relativistic corrections as well as zero-point vibrational effects.

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Cite This Study

Robles-Navarro et al. (2026) studied this question.

synapsesocial.com/papers/699011932ccff479cfe58614https://doi.org/10.1039/d5cp04548g
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