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  1. Third-Parties
  2. MatprojStructure
  3. mp-762089

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-762089
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 114
  • Number of elements: 5
  • Element list: ['Na', 'Sn', 'H', 'Se', 'O']
  • Chemical System: H-Na-O-Se-Sn
  • Density: 2.1741200747660727
  • Atomic Density: 0.09159737316161454
  • Unit Cell Volume: 1244.5771757980247
  • Molar Volume: 6.57457801696401
  • Full Formula: Na8 Sn2 H64 Se8 O32
  • Reduced Formula: Na4SnH32(SeO4)4
  • Formula Anonymous: AB4C4D16E32
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -562.37964648
  • Final energy per atom: -4.933154793684211
  • 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.