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-114162
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Ca', 'Ge', 'H']
  • Chemical System: Ca-Ge-H
  • Density: 3.66519899449052
  • Atomic Density: 0.07695144369164578
  • Unit Cell Volume: 51.98083113331192
  • Molar Volume: 7.825897047664869
  • Full Formula: Ca1 Ge1 H2
  • Reduced Formula: CaGeH2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m