Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57074
  • 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: 24
  • Number of elements: 4
  • Element list: ['Na', 'Pr', 'Se', 'O']
  • Chemical System: Na-O-Pr-Se
  • Density: 4.325599055656309
  • Atomic Density: 0.06949391442645737
  • Unit Cell Volume: 345.35398096473955
  • Molar Volume: 8.665709522483425
  • Full Formula: Na2 Pr2 Se4 O16
  • Reduced Formula: NaPr(SeO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1