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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104740
  • 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: 8
  • Number of elements: 3
  • Element list: ['Ge', 'Se', 'S']
  • Chemical System: Ge-S-Se
  • Density: 4.616614889076917
  • Atomic Density: 0.04338878243708196
  • Unit Cell Volume: 184.37945364336494
  • Molar Volume: 13.87948778865298
  • Full Formula: Ge4 Se2 S2
  • Reduced Formula: Ge2SeS
  • Formula Anonymous: ABC2
  • Spacegroup Number: 26
  • Spacegroup Symbol: Pmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2