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-24796
  • 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: 11
  • Number of elements: 3
  • Element list: ['U', 'Cu', 'As']
  • Chemical System: As-Cu-U
  • Density: 9.335414160955418
  • Atomic Density: 0.05597239990911967
  • Unit Cell Volume: 196.52543070978368
  • Molar Volume: 10.759125515035857
  • Full Formula: U2 Cu4 As5
  • Reduced Formula: U2Cu4As5
  • Formula Anonymous: A2B4C5
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm