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  1. Third-Parties
  2. MatprojStructure
  3. mp-1227205

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-1227205
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 5
  • Element list: ['Ca', 'Zn', 'Si', 'Ge', 'O']
  • Chemical System: Ca-Ge-O-Si-Zn
  • Density: 3.8206182898598398
  • Atomic Density: 0.07473767875207968
  • Unit Cell Volume: 642.2463314551943
  • Molar Volume: 8.057703772118323
  • Full Formula: Ca8 Zn4 Si3 Ge5 O28
  • Reduced Formula: Ca8Zn4Si3Ge5O28
  • Formula Anonymous: A3B4C5D8E28
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -333.39629492
  • Final energy per atom: -6.945756144166666
  • 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.