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  1. Third-Parties
  2. MatprojStructure
  3. mp-4807

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-4807
  • 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: 36
  • Number of elements: 3
  • Element list: ['Ag', 'As', 'F']
  • Chemical System: Ag-As-F
  • Density: 3.6944572915677063
  • Atomic Density: 0.06341052320831816
  • Unit Cell Volume: 567.7291114872481
  • Molar Volume: 9.497068397016504
  • Full Formula: Ag4 As4 F28
  • Reduced Formula: AgAsF7
  • Formula Anonymous: ABC7
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -159.48183427
  • Final energy per atom: -4.430050951944445
  • 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.