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  1. Third-Parties
  2. MatprojStructure
  3. mp-630711

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-630711
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 4
  • Element list: ['Cs', 'Gd', 'Si', 'S']
  • Chemical System: Cs-Gd-S-Si
  • Density: 3.7824701644803818
  • Atomic Density: 0.03571100434021515
  • Unit Cell Volume: 784.0720393424618
  • Molar Volume: 16.863543524644868
  • Full Formula: Cs4 Gd4 Si4 S16
  • Reduced Formula: CsGdSiS4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 19
  • Spacegroup Symbol: P2_12_121
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -196.29459508
  • Final energy per atom: -7.010521252857143
  • 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.