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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-120102
  • 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: 3
  • Number of elements: 3
  • Element list: ['Y', 'Cl', 'O']
  • Chemical System: Cl-O-Y
  • Density: 4.354423933064306
  • Atomic Density: 0.05604861957744877
  • Unit Cell Volume: 53.52495784226332
  • Molar Volume: 10.744494343305853
  • Full Formula: Y1 Cl1 O1
  • Reduced Formula: YClO
  • Formula Anonymous: ABC
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m