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-110132
  • 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: 6
  • Number of elements: 3
  • Element list: ['Y', 'Fe', 'Cu']
  • Chemical System: Cu-Fe-Y
  • Density: 7.317932247997644
  • Atomic Density: 0.0634713651475976
  • Unit Cell Volume: 94.53081694473528
  • Molar Volume: 9.487964763316482
  • Full Formula: Y2 Fe2 Cu2
  • Reduced Formula: YFeCu
  • Formula Anonymous: ABC
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm