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  1. Third-Parties
  2. MatprojStructure
  3. mp-1219572

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-1219572
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 5
  • Number of elements: 4
  • Element list: ['Rb', 'Li', 'Mn', 'S']
  • Chemical System: Li-Mn-Rb-S
  • Density: 3.4919125552309307
  • Atomic Density: 0.04971889224203019
  • Unit Cell Volume: 100.56539425014014
  • Molar Volume: 12.11237919518477
  • Full Formula: Rb1 Li1 Mn1 S2
  • Reduced Formula: RbLiMnS2
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 119
  • Spacegroup Symbol: I-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -25.88558806
  • Final energy per atom: -5.177117612
  • 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.