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-11128
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Sm', 'As', 'O']
  • Chemical System: As-O-Sm
  • Density: 6.386160690172816
  • Atomic Density: 0.07976728075607889
  • Unit Cell Volume: 150.43762161950727
  • Molar Volume: 7.549637774935766
  • Full Formula: Sm2 As2 O8
  • Reduced Formula: SmAsO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m