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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202600

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-1202600
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 62
  • Number of elements: 5
  • Element list: ['Zn', 'Ag', 'Sn', 'Se', 'N']
  • Chemical System: Ag-N-Se-Sn-Zn
  • Density: 4.24428096955151
  • Atomic Density: 0.035608519464880924
  • Unit Cell Volume: 1741.156356167737
  • Molar Volume: 16.912078487114204
  • Full Formula: Zn10 Ag8 Sn6 Se26 N12
  • Reduced Formula: Zn5Ag4Sn3Se13N6
  • Formula Anonymous: A3B4C5D6E13
  • Spacegroup Number: 219
  • Spacegroup Symbol: F-43c
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -225.23272834
  • Final energy per atom: -3.6327859409677417
  • 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.