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-112989
  • 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: ['Sr', 'Lu', 'Se']
  • Chemical System: Lu-Se-Sr
  • Density: 6.702762869173107
  • Atomic Density: 0.03750426343335338
  • Unit Cell Volume: 746.5817866215972
  • Molar Volume: 16.057216456741227
  • Full Formula: Sr4 Lu8 Se16
  • Reduced Formula: Sr(LuSe2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm