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-89898
  • 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: 9
  • Number of elements: 3
  • Element list: ['Sc', 'Cu', 'Ge']
  • Chemical System: Cu-Ge-Sc
  • Density: 6.1247489254266485
  • Atomic Density: 0.06108597356749395
  • Unit Cell Volume: 147.33333160444585
  • Molar Volume: 9.858467350685885
  • Full Formula: Sc3 Cu3 Ge3
  • Reduced Formula: ScCuGe
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m