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  1. Third-Parties
  2. MatprojStructure
  3. mp-1224714

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-1224714
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 118
  • Number of elements: 5
  • Element list: ['K', 'Sr', 'Si', 'H', 'O']
  • Chemical System: H-K-O-Si-Sr
  • Density: 2.575757197863396
  • Atomic Density: 0.08354935024497105
  • Unit Cell Volume: 1412.3389308716087
  • Molar Volume: 7.207884612319269
  • Full Formula: K2 Sr8 Si16 H34 O58
  • Reduced Formula: KSr4Si8H17O29
  • Formula Anonymous: AB4C8D17E29
  • Spacegroup Number: 104
  • Spacegroup Symbol: P4nc
  • Crystal System: tetragonal
  • Pointgroup: 4mm

Thermodynamics:

  • Final energy: -791.81851003
  • Final energy per atom: -6.710326356186441
  • 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.