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  1. Third-Parties
  2. MatprojStructure
  3. mp-1077942

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-1077942
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['Rb', 'Te', 'Se']
  • Chemical System: Rb-Se-Te
  • Density: 4.2138010290749985
  • Atomic Density: 0.02891272384245786
  • Unit Cell Volume: 242.10793967881418
  • Molar Volume: 20.82868702656297
  • Full Formula: Rb2 Te1 Se4
  • Reduced Formula: Rb2TeSe4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -25.359373490000003
  • Final energy per atom: -3.6227676414285717
  • 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.