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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-28563
  • 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: 9
  • Number of elements: 4
  • Element list: ['Te', 'Mo', 'Se', 'S']
  • Chemical System: Mo-S-Se-Te
  • Density: 6.453907568975825
  • Atomic Density: 0.045720922087194485
  • Unit Cell Volume: 196.8464236752723
  • Molar Volume: 13.171520794167625
  • Full Formula: Te2 Mo3 Se2 S2
  • Reduced Formula: Te2Mo3(SeS)2
  • Formula Anonymous: A2B2C2D3
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m