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  1. Third-Parties
  2. MatprojStructure
  3. mp-557516

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-557516
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 5
  • Element list: ['K', 'Be', 'Zn', 'Si', 'O']
  • Chemical System: Be-K-O-Si-Zn
  • Density: 3.202305800754202
  • Atomic Density: 0.07915114717405367
  • Unit Cell Volume: 505.36222693070835
  • Molar Volume: 7.60840616340947
  • Full Formula: K4 Be4 Zn4 Si6 O22
  • Reduced Formula: K2Be2Zn2Si3O11
  • Formula Anonymous: A2B2C2D3E11
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -278.32590911999995
  • Final energy per atom: -6.958147727999998
  • 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.