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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-30483
  • 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: 32
  • Number of elements: 3
  • Element list: ['P', 'W', 'Cl']
  • Chemical System: Cl-P-W
  • Density: 5.154372723338626
  • Atomic Density: 0.0429506641781974
  • Unit Cell Volume: 745.0408651944392
  • Molar Volume: 14.021065506728432
  • Full Formula: P2 W8 Cl22
  • Reduced Formula: PW4Cl11
  • Formula Anonymous: AB4C11
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm