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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203307

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-1203307
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 140
  • Number of elements: 4
  • Element list: ['Rb', 'U', 'Cu', 'S']
  • Chemical System: Cu-Rb-S-U
  • Density: 4.359614438962931
  • Atomic Density: 0.04116201680125745
  • Unit Cell Volume: 3401.1938889185612
  • Molar Volume: 14.630334536513843
  • Full Formula: Rb24 U8 Cu48 S60
  • Reduced Formula: Rb6U2(Cu4S5)3
  • Formula Anonymous: A2B6C12D15
  • Spacegroup Number: 230
  • Spacegroup Symbol: Ia-3d
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -706.56983164
  • Final energy per atom: -5.046927368857142
  • 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.