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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12952
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['Na', 'P', 'S']
  • Chemical System: Na-P-S
  • Density: 2.2351956810137117
  • Atomic Density: 0.047188367908628126
  • Unit Cell Volume: 339.0666113094047
  • Molar Volume: 12.76191787700902
  • Full Formula: Na6 P2 S8
  • Reduced Formula: Na3PS4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 114
  • Spacegroup Symbol: P-42_1c
  • Crystal System: tetragonal
  • Pointgroup: -42m