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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111905
  • 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: 14
  • Number of elements: 4
  • Element list: ['Mn', 'P', 'O', 'F']
  • Chemical System: F-Mn-O-P
  • Density: 3.55191456032565
  • Atomic Density: 0.08864652618660603
  • Unit Cell Volume: 157.93061050727692
  • Molar Volume: 6.793431191339691
  • Full Formula: Mn2 P2 O8 F2
  • Reduced Formula: MnPO4F
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1