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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-33919
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Te', 'Mo', 'S']
  • Chemical System: Mo-S-Te
  • Density: 6.413442741329947
  • Atomic Density: 0.04267264452901055
  • Unit Cell Volume: 421.81590099865707
  • Molar Volume: 14.112415170111873
  • Full Formula: Te7 Mo6 S5
  • Reduced Formula: Te7Mo6S5
  • Formula Anonymous: A5B6C7
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m