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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220008

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-1220008
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 64
  • Number of elements: 4
  • Element list: ['Rb', 'Ta', 'Cu', 'O']
  • Chemical System: Cu-O-Rb-Ta
  • Density: 7.550734689250041
  • Atomic Density: 0.07745083429652191
  • Unit Cell Volume: 826.3306726300048
  • Molar Volume: 7.775436913880263
  • Full Formula: Rb2 Ta14 Cu6 O42
  • Reduced Formula: RbTa7(CuO7)3
  • Formula Anonymous: AB3C7D21
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -578.88660567
  • Final energy per atom: -9.04510321359375
  • 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.