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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51364
  • 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: 5
  • Element list: ['Na', 'P', 'H', 'N', 'O']
  • Chemical System: H-N-Na-O-P
  • Density: 2.2921504011912304
  • Atomic Density: 0.10440416912709476
  • Unit Cell Volume: 172.40690817708617
  • Molar Volume: 5.768103716882266
  • Full Formula: Na2 P2 H6 N2 O6
  • Reduced Formula: NaPH3NO3
  • Formula Anonymous: ABCD3E3
  • Spacegroup Number: 173
  • Spacegroup Symbol: P6_3
  • Crystal System: hexagonal
  • Pointgroup: 6