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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119166
  • 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: 3
  • Element list: ['Mo', 'Se', 'S']
  • Chemical System: Mo-S-Se
  • Density: 5.9711004626532365
  • Atomic Density: 0.04936780991907321
  • Unit Cell Volume: 283.58560006914774
  • Molar Volume: 12.198517150896238
  • Full Formula: Mo6 Se4 S4
  • Reduced Formula: Mo3(SeS)2
  • Formula Anonymous: A2B2C3
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1