Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-119668
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 28
  • Number of elements: 3
  • Element list: ['Tb', 'Mg', 'S']
  • Chemical System: Mg-S-Tb
  • Density: 4.794993217311717
  • Atomic Density: 0.04296898865304193
  • Unit Cell Volume: 651.6327443982738
  • Molar Volume: 14.015086109255378
  • Full Formula: Tb8 Mg4 S16
  • Reduced Formula: Tb2MgS4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm