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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199634

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-1199634
  • 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: 61
  • Number of elements: 5
  • Element list: ['Na', 'Mg', 'H', 'S', 'O']
  • Chemical System: H-Mg-Na-O-S
  • Density: 1.5584710905321055
  • Atomic Density: 0.10396819816019304
  • Unit Cell Volume: 586.7178721902238
  • Molar Volume: 5.792291168421668
  • Full Formula: Na2 Mg1 H32 S2 O24
  • Reduced Formula: Na2MgH32(SO12)2
  • Formula Anonymous: AB2C2D24E32
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -330.55115404
  • Final energy per atom: -5.418871377704917
  • 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.