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  1. Third-Parties
  2. MatprojStructure
  3. mp-974938

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-974938
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['Rb', 'Li']
  • Chemical System: Li-Rb
  • Density: 1.5591145457043567
  • Atomic Density: 0.01426148763131443
  • Unit Cell Volume: 280.4756490632201
  • Molar Volume: 42.226595960276846
  • Full Formula: Rb3 Li1
  • Reduced Formula: Rb3Li
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -4.26992911
  • Final energy per atom: -1.0674822775
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.