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  1. Third-Parties
  2. MatprojStructure
  3. mp-1215614

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-1215614
  • 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: 40
  • Number of elements: 5
  • Element list: ['Yb', 'Y', 'Al', 'B', 'O']
  • Chemical System: Al-B-O-Y-Yb
  • Density: 4.010755955576287
  • Atomic Density: 0.10803132038760066
  • Unit Cell Volume: 370.262992773631
  • Molar Volume: 5.574439651754172
  • Full Formula: Yb1 Y1 Al6 B8 O24
  • Reduced Formula: YbYAl6(BO3)8
  • Formula Anonymous: ABC6D8E24
  • Spacegroup Number: 155
  • Spacegroup Symbol: R32H
  • Crystal System: trigonal
  • Pointgroup: 32

Thermodynamics:

  • Final energy: -329.97301563
  • Final energy per atom: -8.24932539075
  • 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.