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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51003
  • 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: 14
  • Number of elements: 3
  • Element list: ['Mo', 'H', 'O']
  • Chemical System: H-Mo-O
  • Density: 3.6230597776325446
  • Atomic Density: 0.0943048780380407
  • Unit Cell Volume: 148.4546747873708
  • Molar Volume: 6.385821057496929
  • Full Formula: Mo2 H4 O8
  • Reduced Formula: Mo(HO2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1