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-10487
  • 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: 10
  • Number of elements: 3
  • Element list: ['Li', 'Np', 'O']
  • Chemical System: Li-Np-O
  • Density: 5.795364483162402
  • Atomic Density: 0.10123099969303227
  • Unit Cell Volume: 98.7839696370034
  • Molar Volume: 5.948909699856006
  • Full Formula: Li4 Np1 O5
  • Reduced Formula: Li4NpO5
  • Formula Anonymous: AB4C5
  • Spacegroup Number: 87
  • Spacegroup Symbol: I4/m
  • Crystal System: tetragonal
  • Pointgroup: 4/m