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  1. Third-Parties
  2. MatprojStructure
  3. mp-560019

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-560019
  • 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: 34
  • Number of elements: 4
  • Element list: ['K', 'Ge', 'B', 'O']
  • Chemical System: B-Ge-K-O
  • Density: 3.4713996328807797
  • Atomic Density: 0.07439085650026006
  • Unit Cell Volume: 457.0454165947282
  • Molar Volume: 8.095270095430275
  • Full Formula: K4 Ge6 B4 O20
  • Reduced Formula: K2Ge3(BO5)2
  • Formula Anonymous: A2B2C3D10
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -239.60337191
  • Final energy per atom: -7.047157997352941
  • 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.