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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-2598
  • 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: 7
  • Number of elements: 3
  • Element list: ['Mg', 'N', 'F']
  • Chemical System: F-Mg-N
  • Density: 3.148201428636558
  • Atomic Density: 0.09221458786413497
  • Unit Cell Volume: 75.90989844593244
  • Molar Volume: 6.530572764553005
  • Full Formula: Mg3 N1 F3
  • Reduced Formula: Mg3NF3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m