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-70512
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Be', 'In', 'Ge']
  • Chemical System: Be-Ge-In
  • Density: 5.701182452258247
  • Atomic Density: 0.052425242683094786
  • Unit Cell Volume: 57.22434168087103
  • Molar Volume: 11.48710135001801
  • Full Formula: Be1 In1 Ge1
  • Reduced Formula: BeInGe
  • Formula Anonymous: ABC
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2