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-75638
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Sc', 'As', 'Ru']
  • Chemical System: As-Ru-Sc
  • Density: 8.43952357930481
  • Atomic Density: 0.06313196899611631
  • Unit Cell Volume: 63.359341766230486
  • Molar Volume: 9.538971864429676
  • Full Formula: Sc1 As1 Ru2
  • Reduced Formula: ScAsRu2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m