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  1. Third-Parties
  2. MatprojStructure
  3. mp-1104259

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-1104259
  • 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: 14
  • Number of elements: 3
  • Element list: ['V', 'Cu', 'S']
  • Chemical System: Cu-S-V
  • Density: 4.072739734589639
  • Atomic Density: 0.058458533953651
  • Unit Cell Volume: 239.4859920897082
  • Molar Volume: 10.30155967437478
  • Full Formula: V4 Cu2 S8
  • Reduced Formula: V2CuS4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 119
  • Spacegroup Symbol: I-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -92.28838636
  • Final energy per atom: -6.592027597142858
  • 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.