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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203884

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-1203884
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 72
  • Number of elements: 4
  • Element list: ['Ag', 'H', 'N', 'F']
  • Chemical System: Ag-F-H-N
  • Density: 1.9217988802037234
  • Atomic Density: 0.10683706217979146
  • Unit Cell Volume: 673.9234356597557
  • Molar Volume: 5.636752487508128
  • Full Formula: Ag4 H48 N16 F4
  • Reduced Formula: AgH12N4F
  • Formula Anonymous: ABC4D12
  • Spacegroup Number: 52
  • Spacegroup Symbol: Pnna
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -356.39171980000003
  • Final energy per atom: -4.949884997222223
  • 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.