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-64961
  • 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: 6
  • Number of elements: 3
  • Element list: ['Be', 'Ir', 'Se']
  • Chemical System: Be-Ir-Se
  • Density: 14.327228960434427
  • Atomic Density: 0.060417747446607
  • Unit Cell Volume: 99.30856831930687
  • Molar Volume: 9.967502951549044
  • Full Formula: Be1 Ir4 Se1
  • Reduced Formula: BeIr4Se
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m