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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216829

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-1216829
  • 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: 39
  • Number of elements: 4
  • Element list: ['V', 'Ga', 'Ge', 'S']
  • Chemical System: Ga-Ge-S-V
  • Density: 3.8585683074634214
  • Atomic Density: 0.056786701223875
  • Unit Cell Volume: 686.7805165552232
  • Molar Volume: 10.604843440823243
  • Full Formula: V12 Ga1 Ge2 S24
  • Reduced Formula: V12Ga(GeS12)2
  • Formula Anonymous: AB2C12D24
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -266.28232293
  • Final energy per atom: -6.82775187
  • 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.