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-9077
  • 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: 12
  • Number of elements: 2
  • Element list: ['Li', 'S']
  • Chemical System: Li-S
  • Density: 1.7857314668198758
  • Atomic Density: 0.07021520179641907
  • Unit Cell Volume: 170.90316189352592
  • Molar Volume: 8.576690810432344
  • Full Formula: Li8 S4
  • Reduced Formula: Li2S
  • Formula Anonymous: AB2
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm