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  1. Third-Parties
  2. MatprojStructure
  3. mp-17830

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-17830
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['Rb', 'Ge', 'Au']
  • Chemical System: Au-Ge-Rb
  • Density: 4.4546225572627565
  • Atomic Density: 0.028848268196898626
  • Unit Cell Volume: 554.6260139705753
  • Molar Volume: 20.875224533053316
  • Full Formula: Rb6 Ge8 Au2
  • Reduced Formula: Rb3Ge4Au
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -53.67196382
  • Final energy per atom: -3.35449773875
  • 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.