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  1. Third-Parties
  2. MatprojStructure
  3. mp-1335238

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-1335238
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 4
  • Element list: ['Y', 'Cu', 'Sn', 'S']
  • Chemical System: Cu-S-Sn-Y
  • Density: 4.116884220087983
  • Atomic Density: 0.044928292695699416
  • Unit Cell Volume: 1558.0382827834558
  • Molar Volume: 13.403894069129509
  • Full Formula: Y16 Cu6 Sn6 S42
  • Reduced Formula: Y8Cu3(SnS7)3
  • Formula Anonymous: A3B3C8D21
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -432.9080267
  • Final energy per atom: -6.1844003814285715
  • 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.