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  1. Third-Parties
  2. MatprojStructure
  3. mp-1226317

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-1226317
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 14
  • Number of elements: 5
  • Element list: ['Cr', 'Ag', 'Sn', 'Se', 'S']
  • Chemical System: Ag-Cr-S-Se-Sn
  • Density: 5.19238862424471
  • Atomic Density: 0.043722421445865245
  • Unit Cell Volume: 320.201844660732
  • Molar Volume: 13.773575572561304
  • Full Formula: Cr2 Ag2 Sn2 Se4 S4
  • Reduced Formula: CrAgSn(SeS)2
  • Formula Anonymous: ABCD2E2
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -73.31692495
  • Final energy per atom: -5.236923210714286
  • 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.