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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-38450
  • 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: 4
  • Number of elements: 2
  • Element list: ['Mo', 'H']
  • Chemical System: H-Mo
  • Density: 8.700393135810918
  • Atomic Density: 0.07256222116087209
  • Unit Cell Volume: 55.12510416587041
  • Molar Volume: 8.299278417413351
  • Full Formula: Mo3 H1
  • Reduced Formula: Mo3H
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm