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  1. Third-Parties
  2. MatprojStructure
  3. mp-1198619

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-1198619
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 192
  • Number of elements: 4
  • Element list: ['V', 'Ag', 'I', 'O']
  • Chemical System: Ag-I-O-V
  • Density: 5.05118618817921
  • Atomic Density: 0.0675209223071948
  • Unit Cell Volume: 2843.563053337338
  • Molar Volume: 8.918925503715018
  • Full Formula: V16 Ag16 I32 O128
  • Reduced Formula: VAg(IO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 56
  • Spacegroup Symbol: Pccn
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -1098.05427105
  • Final energy per atom: -5.7190326617187495
  • 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.