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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-89055
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 35
  • Number of elements: 4
  • Element list: ['Ti', 'Mn', 'P', 'O']
  • Chemical System: Mn-O-P-Ti
  • Density: 3.0077333041550376
  • Atomic Density: 0.07766824196182097
  • Unit Cell Volume: 450.6346367052417
  • Molar Volume: 7.753672038772652
  • Full Formula: Ti4 Mn1 P6 O24
  • Reduced Formula: Ti4Mn(PO4)6
  • Formula Anonymous: AB4C6D24
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3