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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103940
  • 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: 20
  • Number of elements: 4
  • Element list: ['Mg', 'H', 'C', 'O']
  • Chemical System: C-H-Mg-O
  • Density: 2.4195775284073955
  • Atomic Density: 0.11532227601042808
  • Unit Cell Volume: 173.42703154932087
  • Molar Volume: 5.2220099778948565
  • Full Formula: Mg2 H4 C6 O8
  • Reduced Formula: MgH2C3O4
  • Formula Anonymous: AB2C3D4
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m